3-methyl-2-[(4-methylpiperazin-1-yl)methyl]-6-nitro-aniline

Systemtic Name: 3-methyl-2-[(4-methylpiperazin-1-yl)methyl]-6-nitro-aniline Openeye Name: 3-methyl-2-[(4-methylpiperazin-1-yl)methyl]-6-nitro-aniline CAS Name: 3-methyl-2-[(4-methyl-1-piperazinyl)methyl]-6-nitroaniline IUPAC Name: 3-methyl-2-[(4-methylpiperazin-1-yl)methyl]-6-nitroaniline Traditional Name: [3-methyl-2-[(4-methylpiperazino)methyl]-6-nitro-phenyl]amine Formula: C13H20N4O2 MolecularWeight: 264.3235

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])N)CN2CCN(CC2)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])N)CN2CCN(CC2)C

InChI

InChI=1S/C13H20N4O2/c1-10-3-4-12(17(18)19)13(14)11(10)9-16-7-5-15(2)6-8-16/h3-4H,5-9,14H2,1-2H3