3-(4-methylpiperazin-1-yl)-4-nitro-2-propyl-aniline

Systemtic Name: 3-(4-methylpiperazin-1-yl)-4-nitro-2-propyl-aniline Openeye Name: 3-(4-methylpiperazin-1-yl)-4-nitro-2-propyl-aniline CAS Name: 3-(4-methyl-1-piperazinyl)-4-nitro-2-propylaniline IUPAC Name: 3-(4-methylpiperazin-1-yl)-4-nitro-2-propylaniline Traditional Name: [3-(4-methylpiperazino)-4-nitro-2-propyl-phenyl]amine Formula: C14H22N4O2 MolecularWeight: 278.35008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1N2CCN(CC2)C)[N+](=O)[O-])N

Isomeric SMILES

CCCC1=C(C=CC(=C1N2CCN(CC2)C)[N+](=O)[O-])N

InChI

InChI=1S/C14H22N4O2/c1-3-4-11-12(15)5-6-13(18(19)20)14(11)17-9-7-16(2)8-10-17/h5-6H,3-4,7-10,15H2,1-2H3