ethyl 3-(4-chlorophenyl)carbonylpyrrolo[2,1-a]isoquinoline-1-carboxylate

Systemtic Name: ethyl 3-(4-chlorophenyl)carbonylpyrrolo[2,1-a]isoquinoline-1-carboxylate Openeye Name: ethyl 3-(4-chlorobenzoyl)pyrrolo[2,1-a]isoquinoline-1-carboxylate CAS Name: 3-[(4-chlorophenyl)-oxomethyl]-1-pyrrolo[2,1-a]isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-chlorobenzoyl)pyrrolo[2,1-a]isoquinoline-1-carboxylate Traditional Name: 3-(4-chlorobenzoyl)pyrrol[2,1-a]isoquinoline-1-carboxylic acid ethyl ester Formula: C22H16ClNO3 MolecularWeight: 377.82034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H16ClNO3/c1-2-27-22(26)18-13-19(21(25)15-7-9-16(23)10-8-15)24-12-11-14-5-3-4-6-17(14)20(18)24/h3-13H,2H2,1H3