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

Systemtic Name: ethyl 4-[5-[(Z)-2-cyano-3-(cyclopentylamino)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(Z)-2-cyano-3-(cyclopentylamino)-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 4-[5-[(Z)-2-cyano-3-(cyclopentylamino)-3-oxoprop-1-enyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(Z)-2-cyano-3-(cyclopentylamino)-3-oxoprop-1-enyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(Z)-2-cyano-3-(cyclopentylamino)-3-keto-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)NC3CCCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C(/C#N)\C(=O)NC3CCCC3

InChI

InChI=1S/C22H22N2O4/c1-2-27-22(26)16-9-7-15(8-10-16)20-12-11-19(28-20)13-17(14-23)21(25)24-18-5-3-4-6-18/h7-13,18H,2-6H2,1H3,(H,24,25)/b17-13-