2-[(4-morpholin-4-yl-2-nitro-phenyl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(4-morpholin-4-yl-2-nitro-phenyl)carbonylamino]ethanoic acid Openeye Name: 2-[(4-morpholino-2-nitro-benzoyl)amino]acetic acid CAS Name: 2-[[[4-(4-morpholinyl)-2-nitrophenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(4-morpholin-4-yl-2-nitrobenzoyl)amino]acetic acid Traditional Name: 2-[(4-morpholino-2-nitro-benzoyl)amino]acetic acid Formula: C13H15N3O6 MolecularWeight: 309.2747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=C(C=C2)C(=O)NCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC(=C(C=C2)C(=O)NCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O6/c17-12(18)8-14-13(19)10-2-1-9(7-11(10)16(20)21)15-3-5-22-6-4-15/h1-2,7H,3-6,8H2,(H,14,19)(H,17,18)