1-(azepin-1-yl)-4-chloranyl-2-phenyl-butan-1-one

Systemtic Name: 1-(azepin-1-yl)-4-chloranyl-2-phenyl-butan-1-one Openeye Name: 1-(azepin-1-yl)-4-chloro-2-phenyl-butan-1-one CAS Name: 1-(1-azepinyl)-4-chloro-2-phenyl-1-butanone IUPAC Name: 1-(azepin-1-yl)-4-chloro-2-phenylbutan-1-one Traditional Name: 1-(azepin-1-yl)-4-chloro-2-phenyl-butan-1-one Formula: C16H16ClNO MolecularWeight: 273.75734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=CN(C=C1)C(=O)C(CCCl)C2=CC=CC=C2

Isomeric SMILES

C1=CC=CN(C=C1)C(=O)C(CCCl)C2=CC=CC=C2

InChI

InChI=1S/C16H16ClNO/c17-11-10-15(14-8-4-3-5-9-14)16(19)18-12-6-1-2-7-13-18/h1-9,12-13,15H,10-11H2