2-azanyl-2-[(3,4-dimethoxyphenyl)-nitro-methoxy]carbonyl-butanoic acid

Systemtic Name: 2-azanyl-2-[(3,4-dimethoxyphenyl)-nitro-methoxy]carbonyl-butanoic acid Openeye Name: 2-amino-2-[(3,4-dimethoxyphenyl)-nitro-methoxy]carbonyl-butanoic acid CAS Name: 2-amino-2-[[(3,4-dimethoxyphenyl)-nitromethoxy]-oxomethyl]butanoic acid IUPAC Name: 2-amino-2-[(3,4-dimethoxyphenyl)-nitromethoxy]carbonylbutanoic acid Traditional Name: 2-amino-2-[(3,4-dimethoxyphenyl)-nitro-methoxy]carbonyl-butyric acid Formula: C14H18N2O8 MolecularWeight: 342.30132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O8/c1-4-14(15,12(17)18)13(19)24-11(16(20)21)8-5-6-9(22-2)10(7-8)23-3/h5-7,11H,4,15H2,1-3H3,(H,17,18)