2-[(3S,5R)-3-bromanyl-5-cyclohexyl-8-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butyl-ethanamide

Systemtic Name: 2-[(3S,5R)-3-bromanyl-5-cyclohexyl-8-methyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butyl-ethanamide Openeye Name: 2-[(3S,5R)-3-bromo-5-cyclohexyl-8-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butyl-acetamide CAS Name: 2-[(3S,5R)-3-bromo-5-cyclohexyl-8-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butylacetamide IUPAC Name: 2-[(3S,5R)-3-bromo-5-cyclohexyl-8-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butylacetamide Traditional Name: 2-[(3S,5R)-3-bromo-5-cyclohexyl-2-keto-8-methyl-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butyl-acetamide Formula: C23H33BrN2O2 MolecularWeight: 449.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(CC(C(=O)N2CC(=O)NC(C)(C)C)Br)C3CCCCC3

Isomeric SMILES

CC1=CC2=C(C=C1)[C@H](C[C@@H](C(=O)N2CC(=O)NC(C)(C)C)Br)C3CCCCC3

InChI

InChI=1S/C23H33BrN2O2/c1-15-10-11-17-18(16-8-6-5-7-9-16)13-19(24)22(28)26(20(17)12-15)14-21(27)25-23(2,3)4/h10-12,16,18-19H,5-9,13-14H2,1-4H3,(H,25,27)/t18-,19+/m1/s1