2-[(2-methyl-3-nitro-phenyl)methylcarbamoylamino]ethanoic acid

Systemtic Name: 2-[(2-methyl-3-nitro-phenyl)methylcarbamoylamino]ethanoic acid Openeye Name: 2-[(2-methyl-3-nitro-phenyl)methylcarbamoylamino]acetic acid CAS Name: 2-[[[(2-methyl-3-nitrophenyl)methylamino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(2-methyl-3-nitrophenyl)methylcarbamoylamino]acetic acid Traditional Name: 2-[(2-methyl-3-nitro-benzyl)carbamoylamino]acetic acid Formula: C11H13N3O5 MolecularWeight: 267.23802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CNC(=O)NCC(=O)O

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CNC(=O)NCC(=O)O

InChI

InChI=1S/C11H13N3O5/c1-7-8(3-2-4-9(7)14(18)19)5-12-11(17)13-6-10(15)16/h2-4H,5-6H2,1H3,(H,15,16)(H2,12,13,17)