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

Systemtic Name: 2-[methyl-(4-nitro-1-propan-2-yl-pyrrol-2-yl)carbonyl-amino]ethanoic acid Openeye Name: 2-[(1-isopropyl-4-nitro-pyrrole-2-carbonyl)-methyl-amino]acetic acid CAS Name: 2-[methyl-[(4-nitro-1-propan-2-yl-2-pyrrolyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[methyl-(4-nitro-1-propan-2-ylpyrrole-2-carbonyl)amino]acetic acid Traditional Name: 2-[(1-isopropyl-4-nitro-pyrrole-2-carbonyl)-methyl-amino]acetic acid Formula: C11H15N3O5 MolecularWeight: 269.2539

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=C1C(=O)N(C)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C=C(C=C1C(=O)N(C)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H15N3O5/c1-7(2)13-5-8(14(18)19)4-9(13)11(17)12(3)6-10(15)16/h4-5,7H,6H2,1-3H3,(H,15,16)