ethyl (5E)-5-[(3-chloranylpropylamino)-phenyl-methylidene]-2,4-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-5-[(3-chloranylpropylamino)-phenyl-methylidene]-2,4-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-5-[(3-chloropropylamino)-phenyl-methylene]-2,4-dimethyl-pyrrole-3-carboxylate CAS Name: (5E)-5-[(3-chloropropylamino)-phenylmethylidene]-2,4-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[(3-chloropropylamino)-phenylmethylidene]-2,4-dimethylpyrrole-3-carboxylate Traditional Name: (5E)-5-[(3-chloropropylamino)-phenyl-methylene]-2,4-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C19H23ClN2O2 MolecularWeight: 346.85112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C2=CC=CC=C2)NCCCCl)N=C1C)C

Isomeric SMILES

CCOC(=O)C1=C(/C(=C(/C2=CC=CC=C2)\NCCCCl)/N=C1C)C

InChI

InChI=1S/C19H23ClN2O2/c1-4-24-19(23)16-13(2)17(22-14(16)3)18(21-12-8-11-20)15-9-6-5-7-10-15/h5-7,9-10,21H,4,8,11-12H2,1-3H3/b18-17+