6-ethyl-6-(3-methoxyphenyl)-1,3,3-trimethyl-azepan-2-one

Systemtic Name: 6-ethyl-6-(3-methoxyphenyl)-1,3,3-trimethyl-azepan-2-one Openeye Name: 6-ethyl-6-(3-methoxyphenyl)-1,3,3-trimethyl-azepan-2-one CAS Name: 6-ethyl-6-(3-methoxyphenyl)-1,3,3-trimethyl-2-azepanone IUPAC Name: 6-ethyl-6-(3-methoxyphenyl)-1,3,3-trimethylazepan-2-one Traditional Name: 6-ethyl-6-(3-methoxyphenyl)-1,3,3-trimethyl-azepan-2-one Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC(C(=O)N(C1)C)(C)C)C2=CC(=CC=C2)OC

Isomeric SMILES

CCC1(CCC(C(=O)N(C1)C)(C)C)C2=CC(=CC=C2)OC

InChI

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