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

Systemtic Name: 2-[(3R,5S)-3-azido-8-methyl-2-oxidanylidene-5-(phenylmethyl)-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butyl-ethanamide Openeye Name: 2-[(3R,5S)-3-azido-5-benzyl-8-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butyl-acetamide CAS Name: 2-[(3R,5S)-3-azido-8-methyl-2-oxo-5-(phenylmethyl)-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butylacetamide IUPAC Name: 2-[(3R,5S)-3-azido-5-benzyl-8-methyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butylacetamide Traditional Name: 2-[(3R,5S)-3-azido-5-benzyl-2-keto-8-methyl-4,5-dihydro-3H-1-benzazepin-1-yl]-N-tert-butyl-acetamide Formula: C24H29N5O2 MolecularWeight: 419.51936

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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)N=[N+]=[N-])CC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)[C@H](C[C@H](C(=O)N2CC(=O)NC(C)(C)C)N=[N+]=[N-])CC3=CC=CC=C3

InChI

InChI=1S/C24H29N5O2/c1-16-10-11-19-18(13-17-8-6-5-7-9-17)14-20(27-28-25)23(31)29(21(19)12-16)15-22(30)26-24(2,3)4/h5-12,18,20H,13-15H2,1-4H3,(H,26,30)/t18-,20+/m0/s1