3-(azepan-1-yl)-1-(4-butoxyphenyl)propan-1-one

Systemtic Name: 3-(azepan-1-yl)-1-(4-butoxyphenyl)propan-1-one Openeye Name: 3-(azepan-1-yl)-1-(4-butoxyphenyl)propan-1-one CAS Name: 3-(1-azepanyl)-1-(4-butoxyphenyl)-1-propanone IUPAC Name: 3-(azepan-1-yl)-1-(4-butoxyphenyl)propan-1-one Traditional Name: 3-(azepan-1-yl)-1-(4-butoxyphenyl)propan-1-one Formula: C19H29NO2 MolecularWeight: 303.43906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCCC2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)CCN2CCCCCC2

InChI

InChI=1S/C19H29NO2/c1-2-3-16-22-18-10-8-17(9-11-18)19(21)12-15-20-13-6-4-5-7-14-20/h8-11H,2-7,12-16H2,1H3