2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-[5-methoxy-1-[(3-methoxyphenyl)methyl]-2-methyl-indol-3-yl]propanoic acid

Systemtic Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-[5-methoxy-1-[(3-methoxyphenyl)methyl]-2-methyl-indol-3-yl]propanoic acid Openeye Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-[5-methoxy-1-[(3-methoxyphenyl)methyl]-2-methyl-indol-3-yl]propanoic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-[5-methoxy-1-[(3-methoxyphenyl)methyl]-2-methyl-3-indolyl]propanoic acid IUPAC Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-[5-methoxy-1-[(3-methoxyphenyl)methyl]-2-methylindol-3-yl]propanoic acid Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-(1-m-anisyl-5-methoxy-2-methyl-indol-3-yl)propionic acid Formula: C31H32N2O7S MolecularWeight: 576.65998

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CC2=C(N(C3=C2C=C(C=C3)OC)CC4=CC(=CC=C4)OC)C)C(=O)O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CC2=C(N(C3=C2C=C(C=C3)OC)CC4=CC(=CC=C4)OC)C)C(=O)O

InChI

InChI=1S/C31H32N2O7S/c1-5-6-16-40-23-10-13-26(14-11-23)41(36,37)32-29(31(34)35)19-27-21(2)33(20-22-8-7-9-24(17-22)38-3)30-15-12-25(39-4)18-28(27)30/h7-15,17-18,29,32H,16,19-20H2,1-4H3,(H,34,35)