[(3S)-2-[(2,5-dimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(3S)-2-[(2,5-dimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(3S)-2-[(2,5-dimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [(3S)-2-[(2,5-dimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-(1-pyrrolidinyl)methanone IUPAC Name: [(3S)-2-[(2,5-dimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(3S)-2-(2,5-dimethoxybenzyl)-3,4-dihydro-1H-isoquinolin-3-yl]-pyrrolidino-methanone Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CC3=CC=CC=C3CC2C(=O)N4CCCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CC3=CC=CC=C3C[C@H]2C(=O)N4CCCC4

InChI

InChI=1S/C23H28N2O3/c1-27-20-9-10-22(28-2)19(13-20)16-25-15-18-8-4-3-7-17(18)14-21(25)23(26)24-11-5-6-12-24/h3-4,7-10,13,21H,5-6,11-12,14-16H2,1-2H3/t21-/m0/s1