2-[1-(carboxymethyl)indol-3-yl]-2-[4-(phenylmethyl)piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[1-(carboxymethyl)indol-3-yl]-2-[4-(phenylmethyl)piperidin-1-yl]ethanoic acid Openeye Name: 2-(4-benzyl-1-piperidyl)-2-[1-(carboxymethyl)indol-3-yl]acetic acid CAS Name: 2-[1-(carboxymethyl)-3-indolyl]-2-[4-(phenylmethyl)-1-piperidinyl]acetic acid IUPAC Name: 2-(4-benzylpiperidin-1-yl)-2-[1-(carboxymethyl)indol-3-yl]acetic acid Traditional Name: 2-(4-benzylpiperidino)-2-[1-(carboxymethyl)indol-3-yl]acetic acid Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(C3=CN(C4=CC=CC=C43)CC(=O)O)C(=O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(C3=CN(C4=CC=CC=C43)CC(=O)O)C(=O)O

InChI

InChI=1S/C24H26N2O4/c27-22(28)16-26-15-20(19-8-4-5-9-21(19)26)23(24(29)30)25-12-10-18(11-13-25)14-17-6-2-1-3-7-17/h1-9,15,18,23H,10-14,16H2,(H,27,28)(H,29,30)