4-[[3,4-bis(bromanyl)phenyl]methyl]-N-(3-methylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[[3,4-bis(bromanyl)phenyl]methyl]-N-(3-methylphenyl)piperazine-1-carboxamide Openeye Name: 4-[(3,4-dibromophenyl)methyl]-N-(m-tolyl)piperazine-1-carboxamide CAS Name: 4-[(3,4-dibromophenyl)methyl]-N-(3-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[(3,4-dibromophenyl)methyl]-N-(3-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-(3,4-dibromobenzyl)-N-(m-tolyl)piperazine-1-carboxamide Formula: C19H21Br2N3O MolecularWeight: 467.19754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)CC3=CC(=C(C=C3)Br)Br

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)CC3=CC(=C(C=C3)Br)Br

InChI

InChI=1S/C19H21Br2N3O/c1-14-3-2-4-16(11-14)22-19(25)24-9-7-23(8-10-24)13-15-5-6-17(20)18(21)12-15/h2-6,11-12H,7-10,13H2,1H3,(H,22,25)