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

Systemtic Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-(5-methoxy-1,2-dimethyl-indol-3-yl)propanoic acid Openeye Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-(5-methoxy-1,2-dimethyl-indol-3-yl)propanoic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-(5-methoxy-1,2-dimethyl-3-indolyl)propanoic acid IUPAC Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-(5-methoxy-1,2-dimethylindol-3-yl)propanoic acid Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]-3-(5-methoxy-1,2-dimethyl-indol-3-yl)propionic acid Formula: C24H26N2O6S MolecularWeight: 470.53804

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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)C)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)C)C)C(=O)O

InChI

InChI=1S/C24H26N2O6S/c1-5-6-13-32-17-7-10-19(11-8-17)33(29,30)25-22(24(27)28)15-20-16(2)26(3)23-12-9-18(31-4)14-21(20)23/h7-12,14,22,25H,13,15H2,1-4H3,(H,27,28)