2-[(3-nitrophenyl)methylcarbamoylamino]ethanoic acid

Systemtic Name: 2-[(3-nitrophenyl)methylcarbamoylamino]ethanoic acid Openeye Name: 2-[(3-nitrophenyl)methylcarbamoylamino]acetic acid CAS Name: 2-[[[(3-nitrophenyl)methylamino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(3-nitrophenyl)methylcarbamoylamino]acetic acid Traditional Name: 2-[(3-nitrobenzyl)carbamoylamino]acetic acid Formula: C10H11N3O5 MolecularWeight: 253.21144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CNC(=O)NCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CNC(=O)NCC(=O)O

InChI

InChI=1S/C10H11N3O5/c14-9(15)6-12-10(16)11-5-7-2-1-3-8(4-7)13(17)18/h1-4H,5-6H2,(H,14,15)(H2,11,12,16)