5-(1-methoxypropan-2-ylamino)-2-nitro-benzoic acid

Systemtic Name: 5-(1-methoxypropan-2-ylamino)-2-nitro-benzoic acid Openeye Name: 5-[(2-methoxy-1-methyl-ethyl)amino]-2-nitro-benzoic acid CAS Name: 5-(1-methoxypropan-2-ylamino)-2-nitrobenzoic acid IUPAC Name: 5-(1-methoxypropan-2-ylamino)-2-nitrobenzoic acid Traditional Name: 5-[(2-methoxy-1-methyl-ethyl)amino]-2-nitro-benzoic acid Formula: C11H14N2O5 MolecularWeight: 254.23926

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(COC)NC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H14N2O5/c1-7(6-18-2)12-8-3-4-10(13(16)17)9(5-8)11(14)15/h3-5,7,12H,6H2,1-2H3,(H,14,15)