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

Systemtic Name: 3,4-dimethyl-2,5-dinitro-N-pentan-3-yl-aniline Openeye Name: N-(1-ethylpropyl)-3,4-dimethyl-2,5-dinitro-aniline CAS Name: 3,4-dimethyl-2,5-dinitro-N-pentan-3-ylaniline IUPAC Name: 3,4-dimethyl-2,5-dinitro-N-pentan-3-ylaniline Traditional Name: (3,4-dimethyl-2,5-dinitro-phenyl)-(1-ethylpropyl)amine Formula: C13H19N3O4 MolecularWeight: 281.30766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O4/c1-5-10(6-2)14-11-7-12(15(17)18)8(3)9(4)13(11)16(19)20/h7,10,14H,5-6H2,1-4H3