3-(aminomethyl)-2-(2-methylpropyl)-4-phenyl-isoquinolin-1-one

Systemtic Name: 3-(aminomethyl)-2-(2-methylpropyl)-4-phenyl-isoquinolin-1-one Openeye Name: 3-(aminomethyl)-2-isobutyl-4-phenyl-isoquinolin-1-one CAS Name: 3-(aminomethyl)-2-(2-methylpropyl)-4-phenyl-1-isoquinolinone IUPAC Name: 3-(aminomethyl)-2-(2-methylpropyl)-4-phenylisoquinolin-1-one Traditional Name: 3-(aminomethyl)-2-isobutyl-4-phenyl-isocarbostyril Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)CN

Isomeric SMILES

CC(C)CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)CN

InChI

InChI=1S/C20H22N2O/c1-14(2)13-22-18(12-21)19(15-8-4-3-5-9-15)16-10-6-7-11-17(16)20(22)23/h3-11,14H,12-13,21H2,1-2H3