methyl 2,5-dimethyl-4-(2-phenyl-1H-indol-3-yl)-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: methyl 2,5-dimethyl-4-(2-phenyl-1H-indol-3-yl)-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: methyl 1-benzyl-2,5-dimethyl-4-(2-phenyl-1H-indol-3-yl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-(2-phenyl-1H-indol-3-yl)-1-(phenylmethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-2,5-dimethyl-4-(2-phenyl-1H-indol-3-yl)pyrrole-3-carboxylate Traditional Name: 1-benzyl-2,5-dimethyl-4-(2-phenyl-1H-indol-3-yl)pyrrole-3-carboxylic acid methyl ester Formula: C29H26N2O2 MolecularWeight: 434.52894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)OC)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)OC)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C29H26N2O2/c1-19-25(26(29(32)33-3)20(2)31(19)18-21-12-6-4-7-13-21)27-23-16-10-11-17-24(23)30-28(27)22-14-8-5-9-15-22/h4-17,30H,18H2,1-3H3