(3S)-3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: (3S)-3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: (3S)-3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-isoquinolin-1-one CAS Name: (3S)-3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: (3S)-3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: (3S)-3-(3,4-dimethoxyphenyl)-3,4-dihydroisocarbostyril Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC3=CC=CC=C3C(=O)N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2CC3=CC=CC=C3C(=O)N2)OC

InChI

InChI=1S/C17H17NO3/c1-20-15-8-7-12(10-16(15)21-2)14-9-11-5-3-4-6-13(11)17(19)18-14/h3-8,10,14H,9H2,1-2H3,(H,18,19)/t14-/m0/s1