(3R,4S)-3-azido-7-chloranyl-4-(4-methoxyphenyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: (3R,4S)-3-azido-7-chloranyl-4-(4-methoxyphenyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: (3R,4S)-3-azido-7-chloro-4-(4-methoxyphenyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: (3R,4S)-3-azido-7-chloro-4-(4-methoxyphenyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: (3R,4S)-3-azido-7-chloro-4-(4-methoxyphenyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: (3R,4S)-3-azido-7-chloro-4-(4-methoxyphenyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C17H15ClN4O2 MolecularWeight: 342.7796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC3=C(C=CC(=C3)Cl)NC(=O)C2N=[N+]=[N-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2CC3=C(C=CC(=C3)Cl)NC(=O)[C@@H]2N=[N+]=[N-]

InChI

InChI=1S/C17H15ClN4O2/c1-24-13-5-2-10(3-6-13)14-9-11-8-12(18)4-7-15(11)20-17(23)16(14)21-22-19/h2-8,14,16H,9H2,1H3,(H,20,23)/t14-,16+/m0/s1