1-(carboxymethyl)-2-[3-(3-methoxycarbonylphenoxy)propyl]-3-(4-phenylcyclohexen-1-yl)indole-6-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-2-[3-(3-methoxycarbonylphenoxy)propyl]-3-(4-phenylcyclohexen-1-yl)indole-6-carboxylic acid Openeye Name: 1-(carboxymethyl)-2-[3-(3-methoxycarbonylphenoxy)propyl]-3-(4-phenylcyclohexen-1-yl)indole-6-carboxylic acid CAS Name: 1-(carboxymethyl)-2-[3-(3-methoxycarbonylphenoxy)propyl]-3-(4-phenyl-1-cyclohexenyl)-6-indolecarboxylic acid IUPAC Name: 1-(carboxymethyl)-2-[3-(3-methoxycarbonylphenoxy)propyl]-3-(4-phenylcyclohexen-1-yl)indole-6-carboxylic acid Traditional Name: 2-[3-(3-carbomethoxyphenoxy)propyl]-1-(carboxymethyl)-3-(4-phenylcyclohexen-1-yl)indole-6-carboxylic acid Formula: C34H33NO7 MolecularWeight: 567.62832

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCCCC2=C(C3=C(N2CC(=O)O)C=C(C=C3)C(=O)O)C4=CCC(CC4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCCCC2=C(C3=C(N2CC(=O)O)C=C(C=C3)C(=O)O)C4=CCC(CC4)C5=CC=CC=C5

InChI

InChI=1S/C34H33NO7/c1-41-34(40)26-9-5-10-27(19-26)42-18-6-11-29-32(24-14-12-23(13-15-24)22-7-3-2-4-8-22)28-17-16-25(33(38)39)20-30(28)35(29)21-31(36)37/h2-5,7-10,14,16-17,19-20,23H,6,11-13,15,18,21H2,1H3,(H,36,37)(H,38,39)