2-[1-[(2-carboxyphenyl)methoxyamino]ethylcarbamoyl]-4-nitro-benzoic acid

Systemtic Name: 2-[1-[(2-carboxyphenyl)methoxyamino]ethylcarbamoyl]-4-nitro-benzoic acid Openeye Name: 2-[1-[(2-carboxyphenyl)methoxyamino]ethylcarbamoyl]-4-nitro-benzoic acid CAS Name: 2-[[1-[(2-carboxyphenyl)methoxyamino]ethylamino]-oxomethyl]-4-nitrobenzoic acid IUPAC Name: 2-[1-[(2-carboxyphenyl)methoxyamino]ethylcarbamoyl]-4-nitrobenzoic acid Traditional Name: 2-[1-[(2-carboxybenzyl)oxyamino]ethylcarbamoyl]-4-nitro-benzoic acid Formula: C18H17N3O8 MolecularWeight: 403.34288

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)O)NOCC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(NC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])C(=O)O)NOCC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H17N3O8/c1-10(20-29-9-11-4-2-3-5-13(11)17(23)24)19-16(22)15-8-12(21(27)28)6-7-14(15)18(25)26/h2-8,10,20H,9H2,1H3,(H,19,22)(H,23,24)(H,25,26)