methyl (3S,4R)-2-methylidene-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)-3,4-dihydrophenanthrene-3-carboxylate

Systemtic Name: methyl (3S,4R)-2-methylidene-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)-3,4-dihydrophenanthrene-3-carboxylate Openeye Name: methyl (3S,4R)-2-methylene-1-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydrophenanthrene-3-carboxylate CAS Name: (3S,4R)-2-methylene-1-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydrophenanthrene-3-carboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-2-methylidene-1-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydrophenanthrene-3-carboxylate Traditional Name: (3S,4R)-1-keto-2-methylene-4-(3,4,5-trimethoxyphenyl)-3,4-dihydrophenanthrene-3-carboxylic acid methyl ester Formula: C26H24O6 MolecularWeight: 432.46516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C(C(=C)C(=O)C3=C2C4=CC=CC=C4C=C3)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H](C(=C)C(=O)C3=C2C4=CC=CC=C4C=C3)C(=O)OC

InChI

InChI=1S/C26H24O6/c1-14-21(26(28)32-5)22(16-12-19(29-2)25(31-4)20(13-16)30-3)23-17-9-7-6-8-15(17)10-11-18(23)24(14)27/h6-13,21-22H,1H2,2-5H3/t21-,22+/m1/s1