N-Methyl-N-[(3β,5α,20S)-20-(methylamino)pregnan-3-yl]benzamide
CAS Registry Number®
957466-16-9
CAS Name
N-Methyl-N-[(3β,5α,20S)-20-(methylamino)pregnan-3-yl]benzamideMolecular Formula
C30H46N2OMolecular Mass
450.70Cite this Page
N-Methyl-N-[(3β,5α,20S)-20-(methylamino)pregnan-3-yl]benzamide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=957466-16-9 (retrieved ) (CAS RN: 957466-16-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C30H46N2O/c1-20(31-4)25-13-14-26-24-12-11-22-19-23(32(5)28(33)21-9-7-6-8-10-21)15-17-29(22,2)27(24)16-18-30(25,26)3/h6-10,20,22-27,31H,11-19H2,1-5H3/t20-,22-,23-,24-,25+,26-,27-,29-,30+/m0/s1
InChIKey
InChIKey=NISGMKNSSUMSSN-IBWRYCSWSA-N
SMILES
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](NC)C)(CC4)[H])[H])(CC[C@]1(C[C@@H](N(C(=O)C5=CC=CC=C5)C)CC2)[H])[H])[H]
Canonical SMILES
O=C(C=1C=CC=CC1)N(C)C2CCC3(C)C(CCC4C5CCC(C(NC)C)C5(C)CCC43)C2
Other Names for this Substance
- Benzamide, N-methyl-N-[(3β,5α,20S)-20-(methylamino)pregnan-3-yl]-
- N-Methyl-N-[(3β,5α,20S)-20-(methylamino)pregnan-3-yl]benzamide
- Hookerianamide I