4,5-dimethyl-2-nitro-N-pentan-3-yl-aniline

Systemtic Name: 4,5-dimethyl-2-nitro-N-pentan-3-yl-aniline Openeye Name: N-(1-ethylpropyl)-4,5-dimethyl-2-nitro-aniline CAS Name: 4,5-dimethyl-2-nitro-N-pentan-3-ylaniline IUPAC Name: 4,5-dimethyl-2-nitro-N-pentan-3-ylaniline Traditional Name: (4,5-dimethyl-2-nitro-phenyl)-(1-ethylpropyl)amine Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C(=C1)C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NC1=C(C=C(C(=C1)C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O2/c1-5-11(6-2)14-12-7-9(3)10(4)8-13(12)15(16)17/h7-8,11,14H,5-6H2,1-4H3