2-[cyclopropylmethyl-(1-methyl-5-nitro-pyrrol-2-yl)carbonyl-amino]ethanoic acid

Systemtic Name: 2-[cyclopropylmethyl-(1-methyl-5-nitro-pyrrol-2-yl)carbonyl-amino]ethanoic acid Openeye Name: 2-[cyclopropylmethyl-(1-methyl-5-nitro-pyrrole-2-carbonyl)amino]acetic acid CAS Name: 2-[cyclopropylmethyl-[(1-methyl-5-nitro-2-pyrrolyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[cyclopropylmethyl-(1-methyl-5-nitropyrrole-2-carbonyl)amino]acetic acid Traditional Name: 2-[cyclopropylmethyl-(1-methyl-5-nitro-pyrrole-2-carbonyl)amino]acetic acid Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1[N+](=O)[O-])C(=O)N(CC2CC2)CC(=O)O

Isomeric SMILES

CN1C(=CC=C1[N+](=O)[O-])C(=O)N(CC2CC2)CC(=O)O

InChI

InChI=1S/C12H15N3O5/c1-13-9(4-5-10(13)15(19)20)12(18)14(7-11(16)17)6-8-2-3-8/h4-5,8H,2-3,6-7H2,1H3,(H,16,17)