ethyl 4-[5-(2-cyano-3-oxidanylidene-3-piperidin-1-yl-prop-1-enyl)furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-(2-cyano-3-oxidanylidene-3-piperidin-1-yl-prop-1-enyl)furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[2-cyano-3-oxo-3-(1-piperidyl)prop-1-enyl]-2-furyl]benzoate CAS Name: 4-[5-[2-cyano-3-oxo-3-(1-piperidinyl)prop-1-enyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-(2-cyano-3-oxo-3-piperidin-1-ylprop-1-enyl)furan-2-yl]benzoate Traditional Name: 4-[5-(2-cyano-3-keto-3-piperidino-prop-1-enyl)-2-furyl]benzoic acid ethyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)N3CCCCC3

InChI

InChI=1S/C22H22N2O4/c1-2-27-22(26)17-8-6-16(7-9-17)20-11-10-19(28-20)14-18(15-23)21(25)24-12-4-3-5-13-24/h6-11,14H,2-5,12-13H2,1H3