2-[(1-cyclohexyl-3-nitro-5-oxidanylidene-2H-pyrrol-4-yl)amino]ethanoic acid

Systemtic Name: 2-[(1-cyclohexyl-3-nitro-5-oxidanylidene-2H-pyrrol-4-yl)amino]ethanoic acid Openeye Name: 2-[(1-cyclohexyl-3-nitro-5-oxo-2H-pyrrol-4-yl)amino]acetic acid CAS Name: 2-[(1-cyclohexyl-3-nitro-5-oxo-2H-pyrrol-4-yl)amino]acetic acid IUPAC Name: 2-[(1-cyclohexyl-3-nitro-5-oxo-2H-pyrrol-4-yl)amino]acetic acid Traditional Name: 2-[(1-cyclohexyl-2-keto-4-nitro-3-pyrrolin-3-yl)amino]acetic acid Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(=C(C2=O)NCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2CC(=C(C2=O)NCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O5/c16-10(17)6-13-11-9(15(19)20)7-14(12(11)18)8-4-2-1-3-5-8/h8,13H,1-7H2,(H,16,17)