2-[1-(carboxymethyl)-5-methoxy-indol-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[1-(carboxymethyl)-5-methoxy-indol-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[1-(carboxymethyl)-5-methoxy-indol-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetic acid CAS Name: 2-[1-(carboxymethyl)-5-methoxy-3-indolyl]-2-[4-(2-methoxyphenyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[1-(carboxymethyl)-5-methoxyindol-3-yl]-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetic acid Traditional Name: 2-[1-(carboxymethyl)-5-methoxy-indol-3-yl]-2-[4-(2-methoxyphenyl)piperazino]acetic acid Formula: C24H27N3O6 MolecularWeight: 453.48768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C=C2C(C(=O)O)N3CCN(CC3)C4=CC=CC=C4OC)CC(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N(C=C2C(C(=O)O)N3CCN(CC3)C4=CC=CC=C4OC)CC(=O)O

InChI

InChI=1S/C24H27N3O6/c1-32-16-7-8-19-17(13-16)18(14-27(19)15-22(28)29)23(24(30)31)26-11-9-25(10-12-26)20-5-3-4-6-21(20)33-2/h3-8,13-14,23H,9-12,15H2,1-2H3,(H,28,29)(H,30,31)