2-[1-(2-nitrophenyl)ethoxycarbonylamino]butanedioic acid

Systemtic Name: 2-[1-(2-nitrophenyl)ethoxycarbonylamino]butanedioic acid Openeye Name: 2-[1-(2-nitrophenyl)ethoxycarbonylamino]butanedioic acid CAS Name: 2-[[1-(2-nitrophenyl)ethoxy-oxomethyl]amino]butanedioic acid IUPAC Name: 2-[1-(2-nitrophenyl)ethoxycarbonylamino]butanedioic acid Traditional Name: 2-[1-(2-nitrophenyl)ethoxycarbonylamino]succinic acid Formula: C13H14N2O8 MolecularWeight: 326.25886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O8/c1-7(8-4-2-3-5-10(8)15(21)22)23-13(20)14-9(12(18)19)6-11(16)17/h2-5,7,9H,6H2,1H3,(H,14,20)(H,16,17)(H,18,19)