tert-butyl 9-methyl-2-oxidanyl-4-oxidanylidene-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylate

Systemtic Name: tert-butyl 9-methyl-2-oxidanyl-4-oxidanylidene-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylate Openeye Name: tert-butyl 2-hydroxy-9-methyl-4-oxo-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylate CAS Name: 2-hydroxy-9-methyl-4-oxo-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-hydroxy-9-methyl-4-oxo-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylate Traditional Name: 2-hydroxy-4-keto-9-methyl-5,6,8,9-tetrahydro-1H-pyrid[2,3-d]azepine-7-carboxylic acid tert-butyl ester Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC2=C1NC(=CC2=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CN(CCC2=C1NC(=CC2=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H22N2O4/c1-9-8-17(14(20)21-15(2,3)4)6-5-10-11(18)7-12(19)16-13(9)10/h7,9H,5-6,8H2,1-4H3,(H2,16,18,19)