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

Systemtic Name: O4-[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-[2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester O2-ethyl ester IUPAC Name: 4-O-[2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-(3-chloro-4-cyano-anilino)-2-keto-ethyl] ester O2-ethyl ester Formula: C19H18ClN3O5 MolecularWeight: 403.81632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NC2=CC(=C(C=C2)C#N)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)NC2=CC(=C(C=C2)C#N)Cl)C

InChI

InChI=1S/C19H18ClN3O5/c1-4-27-19(26)17-10(2)16(11(3)22-17)18(25)28-9-15(24)23-13-6-5-12(8-21)14(20)7-13/h5-7,22H,4,9H2,1-3H3,(H,23,24)