3-ethyl-3-(3-methoxyphenyl)-1-propyl-azepan-2-one

Systemtic Name: 3-ethyl-3-(3-methoxyphenyl)-1-propyl-azepan-2-one Openeye Name: 3-ethyl-3-(3-methoxyphenyl)-1-propyl-azepan-2-one CAS Name: 3-ethyl-3-(3-methoxyphenyl)-1-propyl-2-azepanone IUPAC Name: 3-ethyl-3-(3-methoxyphenyl)-1-propylazepan-2-one Traditional Name: 3-ethyl-3-(3-methoxyphenyl)-1-propyl-azepan-2-one Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCCC(C1=O)(CC)C2=CC(=CC=C2)OC

Isomeric SMILES

CCCN1CCCCC(C1=O)(CC)C2=CC(=CC=C2)OC

InChI

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