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

Systemtic Name: 1-[(3-bromophenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3-bromophenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane CAS Name: 1-[(3-bromophenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-bromophenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3-bromophenyl)-(3,5-dimethylphenyl)methyl]-1,4-diazepane Formula: C20H25BrN2 MolecularWeight: 373.3299

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrN2/c1-15-11-16(2)13-18(12-15)20(17-5-3-6-19(21)14-17)23-9-4-7-22-8-10-23/h3,5-6,11-14,20,22H,4,7-10H2,1-2H3