2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-3-(1-methoxycarbonylindol-3-yl)propanoic acid

Systemtic Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-3-(1-methoxycarbonylindol-3-yl)propanoic acid Openeye Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-3-(1-methoxycarbonylindol-3-yl)propanoic acid CAS Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-3-(1-methoxycarbonyl-3-indolyl)propanoic acid IUPAC Name: 2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]-3-(1-methoxycarbonylindol-3-yl)propanoic acid Traditional Name: 3-(1-carbomethoxyindol-3-yl)-2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]propionic acid Formula: C25H21ClN2O6S MolecularWeight: 512.96204

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C=C(C2=CC=CC=C21)CC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)N1C=C(C2=CC=CC=C21)CC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClN2O6S/c1-34-25(31)28-15-18(21-4-2-3-5-23(21)28)14-22(24(29)30)27-35(32,33)20-12-8-17(9-13-20)16-6-10-19(26)11-7-16/h2-13,15,22,27H,14H2,1H3,(H,29,30)