4-[(2-methylphenyl)methyl]-1-(4-piperidin-1-ylphenyl)carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-[(2-methylphenyl)methyl]-1-(4-piperidin-1-ylphenyl)carbonyl-1,4-diazepan-5-one Openeye Name: 4-(o-tolylmethyl)-1-[4-(1-piperidyl)benzoyl]-1,4-diazepan-5-one CAS Name: 4-[(2-methylphenyl)methyl]-1-[oxo-[4-(1-piperidinyl)phenyl]methyl]-1,4-diazepan-5-one IUPAC Name: 4-[(2-methylphenyl)methyl]-1-(4-piperidin-1-ylbenzoyl)-1,4-diazepan-5-one Traditional Name: 4-(2-methylbenzyl)-1-(4-piperidinobenzoyl)-1,4-diazepan-5-one Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CCC2=O)C(=O)C3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CCC2=O)C(=O)C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C25H31N3O2/c1-20-7-3-4-8-22(20)19-28-18-17-27(16-13-24(28)29)25(30)21-9-11-23(12-10-21)26-14-5-2-6-15-26/h3-4,7-12H,2,5-6,13-19H2,1H3