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

Systemtic Name: (6-azanylpyridin-3-yl)-(7-chloranyl-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Openeye Name: (6-amino-3-pyridyl)-(7-chloro-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone CAS Name: (6-amino-3-pyridinyl)-(7-chloro-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone IUPAC Name: (6-aminopyridin-3-yl)-(7-chloro-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Traditional Name: (6-amino-3-pyridyl)-(7-chloro-5-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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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

Isomeric SMILES

COC1CCCN(C2=C1C=C(C=C2)Cl)C(=O)C3=CN=C(C=C3)N

InChI

InChI=1S/C17H18ClN3O2/c1-23-15-3-2-8-21(14-6-5-12(18)9-13(14)15)17(22)11-4-7-16(19)20-10-11/h4-7,9-10,15H,2-3,8H2,1H3,(H2,19,20)