1-(4-methylphenyl)carbonyl-4-(2-phenoxyethyl)-1,4-diazepan-5-one

Systemtic Name: 1-(4-methylphenyl)carbonyl-4-(2-phenoxyethyl)-1,4-diazepan-5-one Openeye Name: 1-(4-methylbenzoyl)-4-(2-phenoxyethyl)-1,4-diazepan-5-one CAS Name: 1-[(4-methylphenyl)-oxomethyl]-4-(2-phenoxyethyl)-1,4-diazepan-5-one IUPAC Name: 1-(4-methylbenzoyl)-4-(2-phenoxyethyl)-1,4-diazepan-5-one Traditional Name: 4-(2-phenoxyethyl)-1-p-toluoyl-1,4-diazepan-5-one Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCC(=O)N(CC2)CCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCC(=O)N(CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3/c1-17-7-9-18(10-8-17)21(25)23-12-11-20(24)22(13-14-23)15-16-26-19-5-3-2-4-6-19/h2-10H,11-16H2,1H3