[2-(1-cyclopropyl-4-methoxycarbonyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: [2-(1-cyclopropyl-4-methoxycarbonyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: [2-(1-cyclopropyl-4-methoxycarbonyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl] 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid [2-(1-cyclopropyl-4-methoxycarbonyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-cyclopropyl-4-methoxycarbonyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl] 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid [2-(4-carbomethoxy-1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)OCC(=O)C2=C(N(C(=C2C(=O)OC)C)C3CC3)C)Cl)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)OCC(=O)C2=C(N(C(=C2C(=O)OC)C)C3CC3)C)Cl)C

InChI

InChI=1S/C21H23ClN2O5/c1-10-8-11(2)23-19(22)16(10)21(27)29-9-15(25)17-12(3)24(14-6-7-14)13(4)18(17)20(26)28-5/h8,14H,6-7,9H2,1-5H3