Methyl 3′-(ethylsulfonyl)-4-methyl-5-nitro[1,1′-biphenyl]-3-carboxylate

CAS Registry Number®

1005499-49-9
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CAS Name

Methyl 3′-(ethylsulfonyl)-4-methyl-5-nitro[1,1′-biphenyl]-3-carboxylate

Molecular Formula

C17H17NO6S

Molecular Mass

363.39

Cite this Page

Methyl 3′-(ethylsulfonyl)-4-methyl-5-nitro[1,1′-biphenyl]-3-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1005499-49-9 (retrieved 2024-09-08) (CAS RN: 1005499-49-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H17NO6S/c1-4-25(22,23)14-7-5-6-12(8-14)13-9-15(17(19)24-3)11(2)16(10-13)18(20)21/h5-10H,4H2,1-3H3

InChIKey

InChIKey=ZGABESXJCIMQSM-UHFFFAOYSA-N

SMILES

C(OC)(=O)C=1C=C(C=C(N(=O)=O)C1C)C2=CC(S(CC)(=O)=O)=CC=C2

Canonical SMILES

O=C(OC)C=1C=C(C=C(C1C)N(=O)=O)C=2C=CC=C(C2)S(=O)(=O)CC

Other Names for this Substance

  • [1,1′-Biphenyl]-3-carboxylic acid, 3′-(ethylsulfonyl)-4-methyl-5-nitro-, methyl ester
  • Methyl 3′-(ethylsulfonyl)-4-methyl-5-nitro[1,1′-biphenyl]-3-carboxylate
  • Methyl 3′-(ethylsulfonyl)-4-methyl-5-nitrobiphenyl-3-carboxylate