N-butan-2-yl-4-(4-methyl-2-nitro-phenoxy)butan-1-amine; ethanedioic acid

Systemtic Name: N-butan-2-yl-4-(4-methyl-2-nitro-phenoxy)butan-1-amine; ethanedioic acid Openeye Name: 4-(4-methyl-2-nitro-phenoxy)-N-sec-butyl-butan-1-amine; oxalic acid CAS Name: N-butan-2-yl-4-(4-methyl-2-nitrophenoxy)-1-butanamine; oxalic acid IUPAC Name: N-butan-2-yl-4-(4-methyl-2-nitrophenoxy)butan-1-amine; oxalic acid Traditional Name: 4-(4-methyl-2-nitro-phenoxy)butyl-sec-butyl-amine; oxalic acid Formula: C17H26N2O7 MolecularWeight: 370.39754

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCCCOC1=C(C=C(C=C1)C)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCCCCOC1=C(C=C(C=C1)C)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C15H24N2O3.C2H2O4/c1-4-13(3)16-9-5-6-10-20-15-8-7-12(2)11-14(15)17(18)19;3-1(4)2(5)6/h7-8,11,13,16H,4-6,9-10H2,1-3H3;(H,3,4)(H,5,6)