ethyl 4-[(Z)-1-chloranyl-3-oxidanylidene-prop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(Z)-1-chloranyl-3-oxidanylidene-prop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(Z)-1-chloro-3-oxo-prop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(Z)-1-chloro-3-oxoprop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(Z)-1-chloro-3-oxoprop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(Z)-1-chloro-3-keto-prop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=CC=O)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)/C(=C/C=O)/Cl)C

InChI

InChI=1S/C12H14ClNO3/c1-4-17-12(16)11-7(2)10(8(3)14-11)9(13)5-6-15/h5-6,14H,4H2,1-3H3/b9-5-