methyl 4-[1-(3-chlorophenyl)-2-cyano-ethyl]-3-(dimethylaminomethylideneamino)-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[1-(3-chlorophenyl)-2-cyano-ethyl]-3-(dimethylaminomethylideneamino)-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[1-(3-chlorophenyl)-2-cyano-ethyl]-3-(dimethylaminomethyleneamino)-1H-pyrrole-2-carboxylate CAS Name: 4-[1-(3-chlorophenyl)-2-cyanoethyl]-3-(dimethylaminomethylideneamino)-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[1-(3-chlorophenyl)-2-cyanoethyl]-3-(dimethylaminomethylideneamino)-1H-pyrrole-2-carboxylate Traditional Name: 4-[1-(3-chlorophenyl)-2-cyano-ethyl]-3-(dimethylaminomethyleneamino)-1H-pyrrole-2-carboxylic acid methyl ester Formula: C18H19ClN4O2 MolecularWeight: 358.82206

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NC1=C(NC=C1C(CC#N)C2=CC(=CC=C2)Cl)C(=O)OC

Isomeric SMILES

CN(C)C=NC1=C(NC=C1C(CC#N)C2=CC(=CC=C2)Cl)C(=O)OC

InChI

InChI=1S/C18H19ClN4O2/c1-23(2)11-22-16-15(10-21-17(16)18(24)25-3)14(7-8-20)12-5-4-6-13(19)9-12/h4-6,9-11,14,21H,7H2,1-3H3