3-(azepan-1-yl)-1-(4-propan-2-yloxyphenyl)propan-1-one

Systemtic Name: 3-(azepan-1-yl)-1-(4-propan-2-yloxyphenyl)propan-1-one Openeye Name: 3-(azepan-1-yl)-1-(4-isopropoxyphenyl)propan-1-one CAS Name: 3-(1-azepanyl)-1-(4-propan-2-yloxyphenyl)-1-propanone IUPAC Name: 3-(azepan-1-yl)-1-(4-propan-2-yloxyphenyl)propan-1-one Traditional Name: 3-(azepan-1-yl)-1-(4-isopropoxyphenyl)propan-1-one Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)CCN2CCCCCC2

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)CCN2CCCCCC2

InChI

InChI=1S/C18H27NO2/c1-15(2)21-17-9-7-16(8-10-17)18(20)11-14-19-12-5-3-4-6-13-19/h7-10,15H,3-6,11-14H2,1-2H3