O2-[2-[(4-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-[(4-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(4-chloro-2-nitro-anilino)-2-oxo-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(4-chloro-2-nitroanilino)-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-(4-chloro-2-nitroanilino)-2-oxoethyl] 4-O-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(4-chloro-2-nitro-anilino)-2-keto-ethyl] ester O4-methyl ester Formula: C18H18ClN3O7 MolecularWeight: 423.80442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)OCC(=O)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)OCC(=O)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C)C(=O)OC

InChI

InChI=1S/C18H18ClN3O7/c1-4-11-15(17(24)28-3)9(2)16(21-11)18(25)29-8-14(23)20-12-6-5-10(19)7-13(12)22(26)27/h5-7,21H,4,8H2,1-3H3,(H,20,23)