2-chloranyl-4-[5-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate

Systemtic Name: 2-chloranyl-4-[5-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate Openeye Name: 2-chloro-4-[5-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 2-chloro-4-[5-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxoprop-1-enyl]-2-furanyl]benzoate IUPAC Name: 2-chloro-4-[5-[(E)-2-cyano-3-(3-methoxypropylamino)-3-oxoprop-1-enyl]furan-2-yl]benzoate Traditional Name: 2-chloro-4-[5-[(E)-2-cyano-3-keto-3-(3-methoxypropylamino)prop-1-enyl]-2-furyl]benzoate Formula: C19H16ClN2O5- MolecularWeight: 387.79374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17ClN2O5/c1-26-8-2-7-22-18(23)13(11-21)9-14-4-6-17(27-14)12-3-5-15(19(24)25)16(20)10-12/h3-6,9-10H,2,7-8H2,1H3,(H,22,23)(H,24,25)/p-1/b13-9+