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

Systemtic Name: methyl 2-[methyl-(4-nitro-1-propan-2-yl-pyrrol-2-yl)carbonyl-amino]ethanoate Openeye Name: methyl 2-[(1-isopropyl-4-nitro-pyrrole-2-carbonyl)-methyl-amino]acetate CAS Name: 2-[methyl-[(4-nitro-1-propan-2-yl-2-pyrrolyl)-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-(4-nitro-1-propan-2-ylpyrrole-2-carbonyl)amino]acetate Traditional Name: 2-[(1-isopropyl-4-nitro-pyrrole-2-carbonyl)-methyl-amino]acetic acid methyl ester Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O5/c1-8(2)14-6-9(15(18)19)5-10(14)12(17)13(3)7-11(16)20-4/h5-6,8H,7H2,1-4H3