3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-[2-[[1-(methoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-, [3S-[2[R*(R*)],3R*]]-
CAS Registry Number®
118194-43-7
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CAS Name
3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-[2-[[1-(methoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-, [3S-[2[R*(R*)],3R*]]-Molecular Formula
C24H28N2O5Molecular Mass
424.49Cite this Page
3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-[2-[[1-(methoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-, [3S-[2[R*(R*)],3R*]]-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=118194-43-7 (retrieved ) (CAS RN: 118194-43-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C24H28N2O5/c1-16(25-20(24(30)31-2)13-12-17-8-4-3-5-9-17)22(27)26-15-19-11-7-6-10-18(19)14-21(26)23(28)29/h3-11,16,20-21,25H,12-15H2,1-2H3,(H,28,29)/t16-,20-,21-/m0/s1
InChIKey
InChIKey=IMIMRLHORUXOFC-NDXORKPFSA-N
SMILES
C([C@@H](N[C@@H](CCC1=CC=CC=C1)C(OC)=O)C)(=O)N2[C@H](C(O)=O)CC=3C(C2)=CC=CC3
Canonical SMILES
O=C(O)C1N(C(=O)C(NC(C(=O)OC)CCC=2C=CC=CC2)C)CC=3C=CC=CC3C1
Other Names for this Substance
- 3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-[2-[[1-(methoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-, [3S-[2[R*(R*)],3R*]]-
