4-[(Z)-(1-butyl-4-methoxycarbonyl-5-methyl-2-oxidanylidene-pyrrol-3-ylidene)methyl]benzoate

Systemtic Name: 4-[(Z)-(1-butyl-4-methoxycarbonyl-5-methyl-2-oxidanylidene-pyrrol-3-ylidene)methyl]benzoate Openeye Name: 4-[(Z)-(1-butyl-4-methoxycarbonyl-5-methyl-2-oxo-pyrrol-3-ylidene)methyl]benzoate CAS Name: 4-[(Z)-(1-butyl-4-methoxycarbonyl-5-methyl-2-oxo-3-pyrrolylidene)methyl]benzoate IUPAC Name: 4-[(Z)-(1-butyl-4-methoxycarbonyl-5-methyl-2-oxopyrrol-3-ylidene)methyl]benzoate Traditional Name: 4-[(Z)-(1-butyl-4-carbomethoxy-2-keto-5-methyl-2-pyrrolin-3-ylidene)methyl]benzoate Formula: C19H20NO5- MolecularWeight: 342.3658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=CC2=CC=C(C=C2)C(=O)[O-])C1=O)C(=O)OC)C

Isomeric SMILES

CCCCN1C(=C(/C(=C/C2=CC=C(C=C2)C(=O)[O-])/C1=O)C(=O)OC)C

InChI

InChI=1S/C19H21NO5/c1-4-5-10-20-12(2)16(19(24)25-3)15(17(20)21)11-13-6-8-14(9-7-13)18(22)23/h6-9,11H,4-5,10H2,1-3H3,(H,22,23)/p-1/b15-11-