ethyl (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(furan-2-yl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(furan-2-yl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(2-furyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(2-furanyl)-2-oxo-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(furan-2-yl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-4-(3,4-dimethoxyphenyl)-6-(2-furyl)-2-keto-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC(=CC1=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CO3

Isomeric SMILES

CCOC(=O)[C@H]1[C@H](CC(=CC1=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CO3

InChI

InChI=1S/C21H22O6/c1-4-26-21(23)20-15(17-6-5-9-27-17)10-14(11-16(20)22)13-7-8-18(24-2)19(12-13)25-3/h5-9,11-12,15,20H,4,10H2,1-3H3/t15-,20+/m1/s1