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

Systemtic Name: 1-(azepan-1-yl)-4-chloranyl-2-(4-ethoxyphenyl)butan-1-one Openeye Name: 1-(azepan-1-yl)-4-chloro-2-(4-ethoxyphenyl)butan-1-one CAS Name: 1-(1-azepanyl)-4-chloro-2-(4-ethoxyphenyl)-1-butanone IUPAC Name: 1-(azepan-1-yl)-4-chloro-2-(4-ethoxyphenyl)butan-1-one Traditional Name: 1-(azepan-1-yl)-4-chloro-2-p-phenetyl-butan-1-one Formula: C18H26ClNO2 MolecularWeight: 323.85754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CCCl)C(=O)N2CCCCCC2

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CCCl)C(=O)N2CCCCCC2

InChI

InChI=1S/C18H26ClNO2/c1-2-22-16-9-7-15(8-10-16)17(11-12-19)18(21)20-13-5-3-4-6-14-20/h7-10,17H,2-6,11-14H2,1H3