6-methoxy-1-oxidanylidene-7-phenylmethoxy-4-(3,4,5-trimethoxyphenyl)isochromene-3-carboxylic acid

Systemtic Name: 6-methoxy-1-oxidanylidene-7-phenylmethoxy-4-(3,4,5-trimethoxyphenyl)isochromene-3-carboxylic acid Openeye Name: 7-benzyloxy-6-methoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isochromene-3-carboxylic acid CAS Name: 6-methoxy-1-oxo-7-phenylmethoxy-4-(3,4,5-trimethoxyphenyl)-2-benzopyran-3-carboxylic acid IUPAC Name: 6-methoxy-1-oxo-7-phenylmethoxy-4-(3,4,5-trimethoxyphenyl)isochromene-3-carboxylic acid Traditional Name: 7-benzoxy-1-keto-6-methoxy-4-(3,4,5-trimethoxyphenyl)isochromene-3-carboxylic acid Formula: C27H24O9 MolecularWeight: 492.47406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(OC(=O)C3=CC(=C(C=C32)OC)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(OC(=O)C3=CC(=C(C=C32)OC)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H24O9/c1-31-19-12-17-18(13-20(19)35-14-15-8-6-5-7-9-15)27(30)36-25(26(28)29)23(17)16-10-21(32-2)24(34-4)22(11-16)33-3/h5-13H,14H2,1-4H3,(H,28,29)