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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)Br)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)Br)N3CCCNCC3

InChI

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