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

Systemtic Name: 1-(azepan-1-yl)-4-chloranyl-2-phenyl-butan-1-one Openeye Name: 1-(azepan-1-yl)-4-chloro-2-phenyl-butan-1-one CAS Name: 1-(1-azepanyl)-4-chloro-2-phenyl-1-butanone IUPAC Name: 1-(azepan-1-yl)-4-chloro-2-phenylbutan-1-one Traditional Name: 1-(azepan-1-yl)-4-chloro-2-phenyl-butan-1-one Formula: C16H22ClNO MolecularWeight: 279.80498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(CCCl)C2=CC=CC=C2

Isomeric SMILES

C1CCCN(CC1)C(=O)C(CCCl)C2=CC=CC=C2

InChI

InChI=1S/C16H22ClNO/c17-11-10-15(14-8-4-3-5-9-14)16(19)18-12-6-1-2-7-13-18/h3-5,8-9,15H,1-2,6-7,10-13H2