N-(4-bromanyl-2-methyl-phenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-(2-nitrophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(2-nitrophenyl)piperazino]acetamide Formula: C19H21BrN4O3 MolecularWeight: 433.29904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H21BrN4O3/c1-14-12-15(20)6-7-16(14)21-19(25)13-22-8-10-23(11-9-22)17-4-2-3-5-18(17)24(26)27/h2-7,12H,8-11,13H2,1H3,(H,21,25)