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4-(1-azanylethyl)-3-nitro-benzoic acid

4-(1-azanylethyl)-3-nitro-benzoic acid

Systemtic Name:4-(1-azanylethyl)-3-nitro-benzoic acid
Openeye Name:4-(1-aminoethyl)-3-nitro-benzoic acid
CAS Name:4-(1-aminoethyl)-3-nitrobenzoic acid
IUPAC Name:4-(1-aminoethyl)-3-nitrobenzoic acid
Traditional Name:4-(1-aminoethyl)-3-nitro-benzoic acid
Formula: C9H10N2O4
MolecularWeight: 210.1867
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H10N2O4/c1-5(10)7-3-2-6(9(12)13)4-8(7)11(14)15/h2-5H,10H2,1H3,(H,12,13)


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