[5-[4-ethyl-4-methyl-2,6-bis(oxidanylidene)piperidin-1-yl]pyridin-2-yl] 3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: [5-[4-ethyl-4-methyl-2,6-bis(oxidanylidene)piperidin-1-yl]pyridin-2-yl] 3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: [5-(4-ethyl-4-methyl-2,6-dioxo-1-piperidyl)-2-pyridyl] 3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid [5-(4-ethyl-4-methyl-2,6-dioxo-1-piperidinyl)-2-pyridinyl] ester IUPAC Name: [5-(4-ethyl-4-methyl-2,6-dioxopiperidin-1-yl)pyridin-2-yl] 3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid [5-(4-ethyl-2,6-diketo-4-methyl-piperidino)-2-pyridyl] ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(=O)N(C(=O)C1)C2=CN=C(C=C2)OC(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CCC1(CC(=O)N(C(=O)C1)C2=CN=C(C=C2)OC(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C23H25N3O4/c1-3-23(2)12-20(27)26(21(28)13-23)18-8-9-19(24-14-18)30-22(29)25-11-10-16-6-4-5-7-17(16)15-25/h4-9,14H,3,10-13,15H2,1-2H3