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

Systemtic Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]-1,4-diazepane CAS Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(2-bromophenyl)-(2,4-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(C2=CC=CC=C2Br)N3CCCNCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C2=CC=CC=C2Br)N3CCCNCC3)C

InChI

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