3-cyclopentyl-1-[4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[4-(3,4-dimethylbenzyl)-1,4-diazepan-1-yl]propan-1-one Formula: C22H34N2O MolecularWeight: 342.51816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2CCCN(CC2)C(=O)CCC3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)CN2CCCN(CC2)C(=O)CCC3CCCC3)C

InChI

InChI=1S/C22H34N2O/c1-18-8-9-21(16-19(18)2)17-23-12-5-13-24(15-14-23)22(25)11-10-20-6-3-4-7-20/h8-9,16,20H,3-7,10-15,17H2,1-2H3