2-chloranyl-5-[5-[(E)-2-cyano-3-(methylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate

Systemtic Name: 2-chloranyl-5-[5-[(E)-2-cyano-3-(methylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate Openeye Name: 2-chloro-5-[5-[(E)-2-cyano-3-(methylamino)-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 2-chloro-5-[5-[(E)-2-cyano-3-(methylamino)-3-oxoprop-1-enyl]-2-furanyl]benzoate IUPAC Name: 2-chloro-5-[5-[(E)-2-cyano-3-(methylamino)-3-oxoprop-1-enyl]furan-2-yl]benzoate Traditional Name: 2-chloro-5-[5-[(E)-2-cyano-3-keto-3-(methylamino)prop-1-enyl]-2-furyl]benzoate Formula: C16H10ClN2O4- MolecularWeight: 329.7146

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=CC1=CC=C(O1)C2=CC(=C(C=C2)Cl)C(=O)[O-])C#N

Isomeric SMILES

CNC(=O)/C(=C/C1=CC=C(O1)C2=CC(=C(C=C2)Cl)C(=O)[O-])/C#N

InChI

InChI=1S/C16H11ClN2O4/c1-19-15(20)10(8-18)6-11-3-5-14(23-11)9-2-4-13(17)12(7-9)16(21)22/h2-7H,1H3,(H,19,20)(H,21,22)/p-1/b10-6+