1-[(2-chloranyl-3,4-dimethoxy-phenyl)methyl]-4-[(2-methylphenyl)methyl]-1,4-diazepan-5-one

Systemtic Name: 1-[(2-chloranyl-3,4-dimethoxy-phenyl)methyl]-4-[(2-methylphenyl)methyl]-1,4-diazepan-5-one Openeye Name: 1-[(2-chloro-3,4-dimethoxy-phenyl)methyl]-4-(o-tolylmethyl)-1,4-diazepan-5-one CAS Name: 1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-4-[(2-methylphenyl)methyl]-1,4-diazepan-5-one IUPAC Name: 1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-4-[(2-methylphenyl)methyl]-1,4-diazepan-5-one Traditional Name: 1-(2-chloro-3,4-dimethoxy-benzyl)-4-(2-methylbenzyl)-1,4-diazepan-5-one Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CCC2=O)CC3=C(C(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CCC2=O)CC3=C(C(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C22H27ClN2O3/c1-16-6-4-5-7-17(16)15-25-13-12-24(11-10-20(25)26)14-18-8-9-19(27-2)22(28-3)21(18)23/h4-9H,10-15H2,1-3H3