4-[1-(phenylmethyl)indol-3-yl]-1H-pyrrole-3-carboxylic acid

Systemtic Name: 4-[1-(phenylmethyl)indol-3-yl]-1H-pyrrole-3-carboxylic acid Openeye Name: 4-(1-benzylindol-3-yl)-1H-pyrrole-3-carboxylic acid CAS Name: 4-[1-(phenylmethyl)-3-indolyl]-1H-pyrrole-3-carboxylic acid IUPAC Name: 4-(1-benzylindol-3-yl)-1H-pyrrole-3-carboxylic acid Traditional Name: 4-(1-benzylindol-3-yl)-1H-pyrrole-3-carboxylic acid Formula: C20H16N2O2 MolecularWeight: 316.35324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C4=CNC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C4=CNC=C4C(=O)O

InChI

InChI=1S/C20H16N2O2/c23-20(24)17-11-21-10-16(17)18-13-22(12-14-6-2-1-3-7-14)19-9-5-4-8-15(18)19/h1-11,13,21H,12H2,(H,23,24)