methyl 4-[1-(phenylmethyl)indol-3-yl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-[1-(phenylmethyl)indol-3-yl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-(1-benzylindol-3-yl)-1H-pyrrole-3-carboxylate CAS Name: 4-[1-(phenylmethyl)-3-indolyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(1-benzylindol-3-yl)-1H-pyrrole-3-carboxylate Traditional Name: 4-(1-benzylindol-3-yl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H18N2O2 MolecularWeight: 330.37982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC=C1C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CNC=C1C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O2/c1-25-21(24)18-12-22-11-17(18)19-14-23(13-15-7-3-2-4-8-15)20-10-6-5-9-16(19)20/h2-12,14,22H,13H2,1H3