2-[(1-cyclopropyl-4-nitro-pyrrol-2-yl)carbonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(1-cyclopropyl-4-nitro-pyrrol-2-yl)carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(1-cyclopropyl-4-nitro-pyrrole-2-carbonyl)-methyl-amino]acetic acid CAS Name: 2-[[(1-cyclopropyl-4-nitro-2-pyrrolyl)-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(1-cyclopropyl-4-nitropyrrole-2-carbonyl)-methylamino]acetic acid Traditional Name: 2-[(1-cyclopropyl-4-nitro-pyrrole-2-carbonyl)-methyl-amino]acetic acid Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=CC(=CN1C2CC2)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=CC(=CN1C2CC2)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O5/c1-12(6-10(15)16)11(17)9-4-8(14(18)19)5-13(9)7-2-3-7/h4-5,7H,2-3,6H2,1H3,(H,15,16)