(7-chloranyl-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-(6-nitropyridin-3-yl)methanone

Systemtic Name: (7-chloranyl-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-(6-nitropyridin-3-yl)methanone Openeye Name: (7-chloro-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-(6-nitro-3-pyridyl)methanone CAS Name: (7-chloro-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-(6-nitro-3-pyridinyl)methanone IUPAC Name: (7-chloro-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-(6-nitropyridin-3-yl)methanone Traditional Name: (7-chloro-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-(6-nitro-3-pyridyl)methanone Formula: C17H16ClN3O4 MolecularWeight: 361.77964

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCN(C2=C1C=C(C=C2)Cl)C(=O)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1CCCN(C2=C1C=C(C=C2)Cl)C(=O)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O4/c1-25-15-3-2-8-20(14-6-5-12(18)9-13(14)15)17(22)11-4-7-16(19-10-11)21(23)24/h4-7,9-10,15H,2-3,8H2,1H3