methyl 4-[2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-keto-2-[(1-methylpyrrole-2-carbonyl)amino]ethoxy]-3-nitro-benzoic acid methyl ester Formula: C16H15N3O7 MolecularWeight: 361.3062

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O7/c1-18-7-3-4-11(18)15(21)17-14(20)9-26-13-6-5-10(16(22)25-2)8-12(13)19(23)24/h3-8H,9H2,1-2H3,(H,17,20,21)