methyl 3-cyano-2-phenyl-pyrrolo[1,2-b]isoquinoline-1-carboxylate

Systemtic Name: methyl 3-cyano-2-phenyl-pyrrolo[1,2-b]isoquinoline-1-carboxylate Openeye Name: methyl 3-cyano-2-phenyl-pyrrolo[1,2-b]isoquinoline-1-carboxylate CAS Name: 3-cyano-2-phenyl-1-pyrrolo[1,2-b]isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 3-cyano-2-phenylpyrrolo[1,2-b]isoquinoline-1-carboxylate Traditional Name: 3-cyano-2-phenyl-pyrrol[1,2-b]isoquinoline-1-carboxylic acid methyl ester Formula: C21H14N2O2 MolecularWeight: 326.34806

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C=C3C=CC=CC3=CN2C(=C1C4=CC=CC=C4)C#N

Isomeric SMILES

COC(=O)C1=C2C=C3C=CC=CC3=CN2C(=C1C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H14N2O2/c1-25-21(24)20-17-11-15-9-5-6-10-16(15)13-23(17)18(12-22)19(20)14-7-3-2-4-8-14/h2-11,13H,1H3