2-(2-azanylpropyl)-4-phenyl-isoquinolin-1-one

Systemtic Name: 2-(2-azanylpropyl)-4-phenyl-isoquinolin-1-one Openeye Name: 2-(2-aminopropyl)-4-phenyl-isoquinolin-1-one CAS Name: 2-(2-aminopropyl)-4-phenyl-1-isoquinolinone IUPAC Name: 2-(2-aminopropyl)-4-phenylisoquinolin-1-one Traditional Name: 2-(2-aminopropyl)-4-phenyl-isocarbostyril Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O/c1-13(19)11-20-12-17(14-7-3-2-4-8-14)15-9-5-6-10-16(15)18(20)21/h2-10,12-13H,11,19H2,1H3