N-[3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]carbonylphenyl]ethanamide

Systemtic Name: N-[3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]carbonylphenyl]ethanamide Openeye Name: N-[3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidine-1-carbonyl]phenyl]acetamide CAS Name: N-[3-[[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidinyl]-oxomethyl]phenyl]acetamide IUPAC Name: N-[3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidine-1-carbonyl]phenyl]acetamide Traditional Name: N-[3-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)piperidine-1-carbonyl]phenyl]acetamide Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)N2CCCC(C2)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)N2CCCC(C2)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C25H31N3O4/c1-17(29)26-21-7-4-6-19(12-21)25(30)28-10-5-8-22(16-28)27-11-9-18-13-23(31-2)24(32-3)14-20(18)15-27/h4,6-7,12-14,22H,5,8-11,15-16H2,1-3H3,(H,26,29)