N4,N4-diethylbenzene-1,4-diamine; 3-nitrophthalic acid

Systemtic Name: N4,N4-diethylbenzene-1,4-diamine; 3-nitrophthalic acid Openeye Name: N4,N4-diethylbenzene-1,4-diamine; 3-nitrophthalic acid CAS Name: N4,N4-diethylbenzene-1,4-diamine; 3-nitrophthalic acid IUPAC Name: 4-N,4-N-diethylbenzene-1,4-diamine; 3-nitrophthalic acid Traditional Name: (4-aminophenyl)-diethyl-amine; 3-nitrophthalic acid Formula: C18H21N3O6 MolecularWeight: 375.37584

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)N.C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)N.C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O

InChI

InChI=1S/C10H16N2.C8H5NO6/c1-3-12(4-2)10-7-5-9(11)6-8-10;10-7(11)4-2-1-3-5(9(14)15)6(4)8(12)13/h5-8H,3-4,11H2,1-2H3;1-3H,(H,10,11)(H,12,13)