2-chloranyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-4-nitro-aniline

Systemtic Name: 2-chloranyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-4-nitro-aniline Openeye Name: 2-chloro-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-4-nitro-aniline CAS Name: 2-chloro-N-[3-methyl-2-(4-methyl-1-piperazinyl)butyl]-4-nitroaniline IUPAC Name: 2-chloro-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-4-nitroaniline Traditional Name: (2-chloro-4-nitro-phenyl)-[3-methyl-2-(4-methylpiperazino)butyl]amine Formula: C16H25ClN4O2 MolecularWeight: 340.8483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCN(CC2)C

Isomeric SMILES

CC(C)C(CNC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCN(CC2)C

InChI

InChI=1S/C16H25ClN4O2/c1-12(2)16(20-8-6-19(3)7-9-20)11-18-15-5-4-13(21(22)23)10-14(15)17/h4-5,10,12,16,18H,6-9,11H2,1-3H3