2-chloranyl-5-[5-[(E)-2-cyano-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-enyl]furan-2-yl]benzoic acid

Systemtic Name: 2-chloranyl-5-[5-[(E)-2-cyano-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-enyl]furan-2-yl]benzoic acid Openeye Name: 2-chloro-5-[5-[(E)-2-cyano-3-oxo-3-pyrrolidin-1-yl-prop-1-enyl]-2-furyl]benzoic acid CAS Name: 2-chloro-5-[5-[(E)-2-cyano-3-oxo-3-(1-pyrrolidinyl)prop-1-enyl]-2-furanyl]benzoic acid IUPAC Name: 2-chloro-5-[5-[(E)-2-cyano-3-oxo-3-pyrrolidin-1-ylprop-1-enyl]furan-2-yl]benzoic acid Traditional Name: 2-chloro-5-[5-[(E)-2-cyano-3-keto-3-pyrrolidino-prop-1-enyl]-2-furyl]benzoic acid Formula: C19H15ClN2O4 MolecularWeight: 370.7864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O)C#N

Isomeric SMILES

C1CCN(C1)C(=O)/C(=C/C2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O)/C#N

InChI

InChI=1S/C19H15ClN2O4/c20-16-5-3-12(10-15(16)19(24)25)17-6-4-14(26-17)9-13(11-21)18(23)22-7-1-2-8-22/h3-6,9-10H,1-2,7-8H2,(H,24,25)/b13-9+