ethyl 4-[[2-(4-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-(4-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[2-(4-methoxyphenyl)-1-oxo-4-isoquinolinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-keto-2-(4-methoxyphenyl)isoquinoline-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H27N3O5/c1-3-33-25(31)27-14-12-17(13-15-27)26-23(29)22-16-28(18-8-10-19(32-2)11-9-18)24(30)21-7-5-4-6-20(21)22/h4-11,16-17H,3,12-15H2,1-2H3,(H,26,29)