4-(1-methoxypropyl)-3-methyl-2,6-dinitro-N-propan-2-yl-aniline

Systemtic Name: 4-(1-methoxypropyl)-3-methyl-2,6-dinitro-N-propan-2-yl-aniline Openeye Name: N-isopropyl-4-(1-methoxypropyl)-3-methyl-2,6-dinitro-aniline CAS Name: 4-(1-methoxypropyl)-3-methyl-2,6-dinitro-N-propan-2-ylaniline IUPAC Name: 4-(1-methoxypropyl)-3-methyl-2,6-dinitro-N-propan-2-ylaniline Traditional Name: isopropyl-[4-(1-methoxypropyl)-3-methyl-2,6-dinitro-phenyl]amine Formula: C14H21N3O5 MolecularWeight: 311.33364

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C(=C1C)[N+](=O)[O-])NC(C)C)[N+](=O)[O-])OC

Isomeric SMILES

CCC(C1=CC(=C(C(=C1C)[N+](=O)[O-])NC(C)C)[N+](=O)[O-])OC

InChI

InChI=1S/C14H21N3O5/c1-6-12(22-5)10-7-11(16(18)19)13(15-8(2)3)14(9(10)4)17(20)21/h7-8,12,15H,6H2,1-5H3