(3-bromophenyl)-[4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-bromophenyl)-[4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (3-bromophenyl)-[4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(3-methylbut-2-enyl)-1,4-diazepan-1-yl]methanone Formula: C17H23BrN2O MolecularWeight: 351.28132

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)Br)C

Isomeric SMILES

CC(=CCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C17H23BrN2O/c1-14(2)7-10-19-8-4-9-20(12-11-19)17(21)15-5-3-6-16(18)13-15/h3,5-7,13H,4,8-12H2,1-2H3