ethyl 2-[3-(dimethylamino)propyl]-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: ethyl 2-[3-(dimethylamino)propyl]-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: ethyl 2-[3-(dimethylamino)propyl]-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-[3-(dimethylamino)propyl]-1-oxo-4-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(dimethylamino)propyl]-1-oxoisoquinoline-4-carboxylate Traditional Name: 2-[3-(dimethylamino)propyl]-1-keto-isoquinoline-4-carboxylic acid ethyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=O)C2=CC=CC=C21)CCCN(C)C

Isomeric SMILES

CCOC(=O)C1=CN(C(=O)C2=CC=CC=C21)CCCN(C)C

InChI

InChI=1S/C17H22N2O3/c1-4-22-17(21)15-12-19(11-7-10-18(2)3)16(20)14-9-6-5-8-13(14)15/h5-6,8-9,12H,4,7,10-11H2,1-3H3