N2-(4-ethoxyphenyl)-N4-heptan-4-yl-6-methyl-3-nitro-pyridine-2,4-diamine

Systemtic Name: N2-(4-ethoxyphenyl)-N4-heptan-4-yl-6-methyl-3-nitro-pyridine-2,4-diamine Openeye Name: N2-(4-ethoxyphenyl)-6-methyl-3-nitro-N4-(1-propylbutyl)pyridine-2,4-diamine CAS Name: N2-(4-ethoxyphenyl)-N4-heptan-4-yl-6-methyl-3-nitropyridine-2,4-diamine IUPAC Name: 2-N-(4-ethoxyphenyl)-4-N-heptan-4-yl-6-methyl-3-nitropyridine-2,4-diamine Traditional Name: [6-methyl-3-nitro-2-(p-phenetidino)-4-pyridyl]-(1-propylbutyl)amine Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=CC(=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)OCC)C

Isomeric SMILES

CCCC(CCC)NC1=CC(=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)OCC)C

InChI

InChI=1S/C21H30N4O3/c1-5-8-16(9-6-2)23-19-14-15(4)22-21(20(19)25(26)27)24-17-10-12-18(13-11-17)28-7-3/h10-14,16H,5-9H2,1-4H3,(H2,22,23,24)