3-(7-chloranyl-2-methyl-1-oxidanylidene-3-phenyl-isoquinolin-4-yl)-N,N-diethyl-propanamide

Systemtic Name: 3-(7-chloranyl-2-methyl-1-oxidanylidene-3-phenyl-isoquinolin-4-yl)-N,N-diethyl-propanamide Openeye Name: 3-(7-chloro-2-methyl-1-oxo-3-phenyl-4-isoquinolyl)-N,N-diethyl-propanamide CAS Name: 3-(7-chloro-2-methyl-1-oxo-3-phenyl-4-isoquinolinyl)-N,N-diethylpropanamide IUPAC Name: 3-(7-chloro-2-methyl-1-oxo-3-phenylisoquinolin-4-yl)-N,N-diethylpropanamide Traditional Name: 3-(7-chloro-1-keto-2-methyl-3-phenyl-4-isoquinolyl)-N,N-diethyl-propionamide Formula: C23H25ClN2O2 MolecularWeight: 396.9098

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCC1=C(N(C(=O)C2=C1C=CC(=C2)Cl)C)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)CCC1=C(N(C(=O)C2=C1C=CC(=C2)Cl)C)C3=CC=CC=C3

InChI

InChI=1S/C23H25ClN2O2/c1-4-26(5-2)21(27)14-13-19-18-12-11-17(24)15-20(18)23(28)25(3)22(19)16-9-7-6-8-10-16/h6-12,15H,4-5,13-14H2,1-3H3