4-[(3,5-dimethylphenyl)methyl]-1-(2-phenoxyethyl)-1,4-diazepan-5-one

Systemtic Name: 4-[(3,5-dimethylphenyl)methyl]-1-(2-phenoxyethyl)-1,4-diazepan-5-one Openeye Name: 4-[(3,5-dimethylphenyl)methyl]-1-(2-phenoxyethyl)-1,4-diazepan-5-one CAS Name: 4-[(3,5-dimethylphenyl)methyl]-1-(2-phenoxyethyl)-1,4-diazepan-5-one IUPAC Name: 4-[(3,5-dimethylphenyl)methyl]-1-(2-phenoxyethyl)-1,4-diazepan-5-one Traditional Name: 4-(3,5-dimethylbenzyl)-1-(2-phenoxyethyl)-1,4-diazepan-5-one Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2CCN(CCC2=O)CCOC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2CCN(CCC2=O)CCOC3=CC=CC=C3)C

InChI

InChI=1S/C22H28N2O2/c1-18-14-19(2)16-20(15-18)17-24-11-10-23(9-8-22(24)25)12-13-26-21-6-4-3-5-7-21/h3-7,14-16H,8-13,17H2,1-2H3