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

Systemtic Name: tert-butyl 3-bromanyl-2-methoxy-4-oxidanylidene-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylate Openeye Name: tert-butyl 3-bromo-2-methoxy-4-oxo-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylate CAS Name: 3-bromo-2-methoxy-4-oxo-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-bromo-2-methoxy-4-oxo-5,6,8,9-tetrahydro-1H-pyrido[2,3-d]azepine-7-carboxylate Traditional Name: 3-bromo-4-keto-2-methoxy-5,6,8,9-tetrahydro-1H-pyrid[2,3-d]azepine-7-carboxylic acid tert-butyl ester Formula: C15H21BrN2O4 MolecularWeight: 373.24224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(CC1)NC(=C(C2=O)Br)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(CC1)NC(=C(C2=O)Br)OC

InChI

InChI=1S/C15H21BrN2O4/c1-15(2,3)22-14(20)18-7-5-9-10(6-8-18)17-13(21-4)11(16)12(9)19/h5-8H2,1-4H3,(H,17,19)