1-[(3,5-dimethylphenyl)-(2-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3,5-dimethylphenyl)-(2-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3,5-dimethylphenyl)-(o-tolyl)methyl]-1,4-diazepane CAS Name: 1-[(3,5-dimethylphenyl)-(2-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,5-dimethylphenyl)-(2-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3,5-dimethylphenyl)-(o-tolyl)methyl]-1,4-diazepane Formula: C21H28N2 MolecularWeight: 308.46042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC(=CC(=C2)C)C)N3CCCNCC3

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC(=CC(=C2)C)C)N3CCCNCC3

InChI

InChI=1S/C21H28N2/c1-16-13-17(2)15-19(14-16)21(20-8-5-4-7-18(20)3)23-11-6-9-22-10-12-23/h4-5,7-8,13-15,21-22H,6,9-12H2,1-3H3