N,4,5-trimethyl-2-nitro-aniline

Systemtic Name: N,4,5-trimethyl-2-nitro-aniline Openeye Name: N,4,5-trimethyl-2-nitro-aniline CAS Name: N,4,5-trimethyl-2-nitroaniline IUPAC Name: N,4,5-trimethyl-2-nitroaniline Traditional Name: (4,5-dimethyl-2-nitro-phenyl)-methyl-amine Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC

InChI

InChI=1S/C9H12N2O2/c1-6-4-8(10-3)9(11(12)13)5-7(6)2/h4-5,10H,1-3H3