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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=C(C=CC(=C2)C)C)N3CCCNCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=C(C=CC(=C2)C)C)N3CCCNCC3

InChI

InChI=1S/C21H28N2/c1-16-6-9-19(10-7-16)21(23-13-4-11-22-12-14-23)20-15-17(2)5-8-18(20)3/h5-10,15,21-22H,4,11-14H2,1-3H3