3,4-dimethyl-6-nitro-N1-pentan-3-yl-benzene-1,2-diamine

Systemtic Name: 3,4-dimethyl-6-nitro-N1-pentan-3-yl-benzene-1,2-diamine Openeye Name: N1-(1-ethylpropyl)-3,4-dimethyl-6-nitro-benzene-1,2-diamine CAS Name: 3,4-dimethyl-6-nitro-N1-pentan-3-ylbenzene-1,2-diamine IUPAC Name: 3,4-dimethyl-6-nitro-1-N-pentan-3-ylbenzene-1,2-diamine Traditional Name: (2-amino-3,4-dimethyl-6-nitro-phenyl)-(1-ethylpropyl)amine Formula: C13H21N3O2 MolecularWeight: 251.32474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C(=C1N)C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NC1=C(C=C(C(=C1N)C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H21N3O2/c1-5-10(6-2)15-13-11(16(17)18)7-8(3)9(4)12(13)14/h7,10,15H,5-6,14H2,1-4H3