(4-bromophenyl) 4-methyl-1,4-diazepane-1-carboxylate

Systemtic Name: (4-bromophenyl) 4-methyl-1,4-diazepane-1-carboxylate Openeye Name: (4-bromophenyl) 4-methyl-1,4-diazepane-1-carboxylate CAS Name: 4-methyl-1,4-diazepane-1-carboxylic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 4-methyl-1,4-diazepane-1-carboxylate Traditional Name: 4-methyl-1,4-diazepane-1-carboxylic acid (4-bromophenyl) ester Formula: C13H17BrN2O2 MolecularWeight: 313.19028

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)OC2=CC=C(C=C2)Br

Isomeric SMILES

CN1CCCN(CC1)C(=O)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H17BrN2O2/c1-15-7-2-8-16(10-9-15)13(17)18-12-5-3-11(14)4-6-12/h3-6H,2,7-10H2,1H3