3-(aminomethyl)-6-chloranyl-4-phenyl-2-propyl-isoquinolin-1-one

Systemtic Name: 3-(aminomethyl)-6-chloranyl-4-phenyl-2-propyl-isoquinolin-1-one Openeye Name: 3-(aminomethyl)-6-chloro-4-phenyl-2-propyl-isoquinolin-1-one CAS Name: 3-(aminomethyl)-6-chloro-4-phenyl-2-propyl-1-isoquinolinone IUPAC Name: 3-(aminomethyl)-6-chloro-4-phenyl-2-propylisoquinolin-1-one Traditional Name: 3-(aminomethyl)-6-chloro-4-phenyl-2-propyl-isocarbostyril Formula: C19H19ClN2O MolecularWeight: 326.81996

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CN

Isomeric SMILES

CCCN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CN

InChI

InChI=1S/C19H19ClN2O/c1-2-10-22-17(12-21)18(13-6-4-3-5-7-13)16-11-14(20)8-9-15(16)19(22)23/h3-9,11H,2,10,12,21H2,1H3