ethyl 3-oxidanylidene-2-[(2-pyrrol-1-ylphenyl)methyl]-1H-isoindole-1-carboxylate

Systemtic Name: ethyl 3-oxidanylidene-2-[(2-pyrrol-1-ylphenyl)methyl]-1H-isoindole-1-carboxylate Openeye Name: ethyl 3-oxo-2-[(2-pyrrol-1-ylphenyl)methyl]isoindoline-1-carboxylate CAS Name: 3-oxo-2-[[2-(1-pyrrolyl)phenyl]methyl]-1H-isoindole-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-oxo-2-[(2-pyrrol-1-ylphenyl)methyl]-1H-isoindole-1-carboxylate Traditional Name: 3-keto-2-(2-pyrrol-1-ylbenzyl)isoindoline-1-carboxylic acid ethyl ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2=CC=CC=C2C(=O)N1CC3=CC=CC=C3N4C=CC=C4

Isomeric SMILES

CCOC(=O)C1C2=CC=CC=C2C(=O)N1CC3=CC=CC=C3N4C=CC=C4

InChI

InChI=1S/C22H20N2O3/c1-2-27-22(26)20-17-10-4-5-11-18(17)21(25)24(20)15-16-9-3-6-12-19(16)23-13-7-8-14-23/h3-14,20H,2,15H2,1H3