(3R,4S)-4-(aminomethyl)-3-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: (3R,4S)-4-(aminomethyl)-3-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-1-one Openeye Name: (3R,4S)-4-(aminomethyl)-2-benzyl-3-phenyl-3,4-dihydroisoquinolin-1-one CAS Name: (3R,4S)-4-(aminomethyl)-3-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: (3R,4S)-4-(aminomethyl)-2-benzyl-3-phenyl-3,4-dihydroisoquinolin-1-one Traditional Name: (3R,4S)-4-(aminomethyl)-2-benzyl-3-phenyl-3,4-dihydroisocarbostyril Formula: C23H22N2O MolecularWeight: 342.43358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(C(C3=CC=CC=C3C2=O)CN)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2[C@H]([C@@H](C3=CC=CC=C3C2=O)CN)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O/c24-15-21-19-13-7-8-14-20(19)23(26)25(16-17-9-3-1-4-10-17)22(21)18-11-5-2-6-12-18/h1-14,21-22H,15-16,24H2/t21-,22+/m1/s1