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

Systemtic Name: 2-[1-(carboxymethyl)-5-methoxy-indol-3-yl]-2-[4-(4-ethanoylphenyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-yl]-2-[1-(carboxymethyl)-5-methoxy-indol-3-yl]acetic acid CAS Name: 2-[4-(4-acetylphenyl)-1-piperazinyl]-2-[1-(carboxymethyl)-5-methoxy-3-indolyl]acetic acid IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-yl]-2-[1-(carboxymethyl)-5-methoxyindol-3-yl]acetic acid Traditional Name: 2-[4-(4-acetylphenyl)piperazino]-2-[1-(carboxymethyl)-5-methoxy-indol-3-yl]acetic acid Formula: C25H27N3O6 MolecularWeight: 465.49838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(C3=CN(C4=C3C=C(C=C4)OC)CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(C3=CN(C4=C3C=C(C=C4)OC)CC(=O)O)C(=O)O

InChI

InChI=1S/C25H27N3O6/c1-16(29)17-3-5-18(6-4-17)26-9-11-27(12-10-26)24(25(32)33)21-14-28(15-23(30)31)22-8-7-19(34-2)13-20(21)22/h3-8,13-14,24H,9-12,15H2,1-2H3,(H,30,31)(H,32,33)