2-(2,3-dimethylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one

Systemtic Name: 2-(2,3-dimethylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Openeye Name: 2-(2,3-dimethylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one CAS Name: 2-(2,3-dimethylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)-1-butanone IUPAC Name: 2-(2,3-dimethylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Traditional Name: 2-(2,3-dimethylphenoxy)-1-(4-methyl-1,4-diazepan-1-yl)butan-1-one Formula: C18H28N2O2 MolecularWeight: 304.42712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCN(CC1)C)OC2=CC=CC(=C2C)C

Isomeric SMILES

CCC(C(=O)N1CCCN(CC1)C)OC2=CC=CC(=C2C)C

InChI

InChI=1S/C18H28N2O2/c1-5-16(22-17-9-6-8-14(2)15(17)3)18(21)20-11-7-10-19(4)12-13-20/h6,8-9,16H,5,7,10-13H2,1-4H3