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

Systemtic Name: ethyl 2,5-dimethyl-4-(2-phenyl-1H-indol-3-yl)-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C30H28N2O2 MolecularWeight: 448.55552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C)CC5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H28N2O2/c1-4-34-30(33)27-21(3)32(19-22-13-7-5-8-14-22)20(2)26(27)28-24-17-11-12-18-25(24)31-29(28)23-15-9-6-10-16-23/h5-18,31H,4,19H2,1-3H3