[5-(4,4-dimethyl-2-oxidanylidene-piperidin-1-yl)pyridin-2-yl] 7-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: [5-(4,4-dimethyl-2-oxidanylidene-piperidin-1-yl)pyridin-2-yl] 7-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: [5-(4,4-dimethyl-2-oxo-1-piperidyl)-2-pyridyl] 7-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 7-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid [5-(4,4-dimethyl-2-oxo-1-piperidinyl)-2-pyridinyl] ester IUPAC Name: [5-(4,4-dimethyl-2-oxopiperidin-1-yl)pyridin-2-yl] 7-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 7-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid [5-(2-keto-4,4-dimethyl-piperidino)-2-pyridyl] ester Formula: C23H27N3O4 MolecularWeight: 409.47818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C(=O)C1)C2=CN=C(C=C2)OC(=O)N3CCC4=C(C3)C=C(C=C4)OC)C

Isomeric SMILES

CC1(CCN(C(=O)C1)C2=CN=C(C=C2)OC(=O)N3CCC4=C(C3)C=C(C=C4)OC)C

InChI

InChI=1S/C23H27N3O4/c1-23(2)9-11-26(21(27)13-23)18-5-7-20(24-14-18)30-22(28)25-10-8-16-4-6-19(29-3)12-17(16)15-25/h4-7,12,14H,8-11,13,15H2,1-3H3