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

Systemtic Name: 1-[(4-bromophenyl)-(2,5-dimethylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-bromophenyl)-(2,5-dimethylphenyl)methyl]-1,4-diazepane CAS Name: 1-[(4-bromophenyl)-(2,5-dimethylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-bromophenyl)-(2,5-dimethylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(4-bromophenyl)-(2,5-dimethylphenyl)methyl]-1,4-diazepane Formula: C20H25BrN2 MolecularWeight: 373.3299

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrN2/c1-15-4-5-16(2)19(14-15)20(17-6-8-18(21)9-7-17)23-12-3-10-22-11-13-23/h4-9,14,20,22H,3,10-13H2,1-2H3