3-bromanyl-N-(2,6-diethyl-4-methoxy-phenyl)-4-methyl-2-oxidanylidene-7,8,9,10-tetrahydro-6H-pyrido[1,2-a]azepine-1-carboxamide

Systemtic Name: 3-bromanyl-N-(2,6-diethyl-4-methoxy-phenyl)-4-methyl-2-oxidanylidene-7,8,9,10-tetrahydro-6H-pyrido[1,2-a]azepine-1-carboxamide Openeye Name: 3-bromo-N-(2,6-diethyl-4-methoxy-phenyl)-4-methyl-2-oxo-7,8,9,10-tetrahydro-6H-pyrido[1,2-a]azepine-1-carboxamide CAS Name: 3-bromo-N-(2,6-diethyl-4-methoxyphenyl)-4-methyl-2-oxo-7,8,9,10-tetrahydro-6H-pyrido[1,2-a]azepine-1-carboxamide IUPAC Name: 3-bromo-N-(2,6-diethyl-4-methoxyphenyl)-4-methyl-2-oxo-7,8,9,10-tetrahydro-6H-pyrido[1,2-a]azepine-1-carboxamide Traditional Name: 3-bromo-N-(2,6-diethyl-4-methoxy-phenyl)-2-keto-4-methyl-7,8,9,10-tetrahydro-6H-pyrid[1,2-a]azepine-1-carboxamide Formula: C23H29BrN2O3 MolecularWeight: 461.39196

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1NC(=O)C2=C3CCCCCN3C(=C(C2=O)Br)C)CC)OC

Isomeric SMILES

CCC1=CC(=CC(=C1NC(=O)C2=C3CCCCCN3C(=C(C2=O)Br)C)CC)OC

InChI

InChI=1S/C23H29BrN2O3/c1-5-15-12-17(29-4)13-16(6-2)21(15)25-23(28)19-18-10-8-7-9-11-26(18)14(3)20(24)22(19)27/h12-13H,5-11H2,1-4H3,(H,25,28)