(3S,4S)-4-(aminomethyl)-2-(phenylmethyl)-3-propan-2-yl-3,4-dihydroisoquinolin-1-one

Systemtic Name: (3S,4S)-4-(aminomethyl)-2-(phenylmethyl)-3-propan-2-yl-3,4-dihydroisoquinolin-1-one Openeye Name: (3S,4S)-4-(aminomethyl)-2-benzyl-3-isopropyl-3,4-dihydroisoquinolin-1-one CAS Name: (3S,4S)-4-(aminomethyl)-2-(phenylmethyl)-3-propan-2-yl-3,4-dihydroisoquinolin-1-one IUPAC Name: (3S,4S)-4-(aminomethyl)-2-benzyl-3-propan-2-yl-3,4-dihydroisoquinolin-1-one Traditional Name: (3S,4S)-4-(aminomethyl)-2-benzyl-3-isopropyl-3,4-dihydroisocarbostyril Formula: C20H24N2O MolecularWeight: 308.41736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(C2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)CN

Isomeric SMILES

CC(C)[C@H]1[C@@H](C2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)CN

InChI

InChI=1S/C20H24N2O/c1-14(2)19-18(12-21)16-10-6-7-11-17(16)20(23)22(19)13-15-8-4-3-5-9-15/h3-11,14,18-19H,12-13,21H2,1-2H3/t18-,19+/m1/s1