3-butyl-3-(3-methoxyphenyl)-1-methyl-azepan-2-one

Systemtic Name: 3-butyl-3-(3-methoxyphenyl)-1-methyl-azepan-2-one Openeye Name: 3-butyl-3-(3-methoxyphenyl)-1-methyl-azepan-2-one CAS Name: 3-butyl-3-(3-methoxyphenyl)-1-methyl-2-azepanone IUPAC Name: 3-butyl-3-(3-methoxyphenyl)-1-methylazepan-2-one Traditional Name: 3-butyl-3-(3-methoxyphenyl)-1-methyl-azepan-2-one Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCCCN(C1=O)C)C2=CC(=CC=C2)OC

Isomeric SMILES

CCCCC1(CCCCN(C1=O)C)C2=CC(=CC=C2)OC

InChI

InChI=1S/C18H27NO2/c1-4-5-11-18(12-6-7-13-19(2)17(18)20)15-9-8-10-16(14-15)21-3/h8-10,14H,4-7,11-13H2,1-3H3