[3-methoxy-4-oxidanylidene-8-[2-(4-phenylbutoxy)phenyl]chromen-2-yl] hydrogen carbonate

Systemtic Name: [3-methoxy-4-oxidanylidene-8-[2-(4-phenylbutoxy)phenyl]chromen-2-yl] hydrogen carbonate Openeye Name: [3-methoxy-4-oxo-8-[2-(4-phenylbutoxy)phenyl]chromen-2-yl] hydrogen carbonate CAS Name: carbonic acid [3-methoxy-4-oxo-8-[2-(4-phenylbutoxy)phenyl]-1-benzopyran-2-yl] ester IUPAC Name: [3-methoxy-4-oxo-8-[2-(4-phenylbutoxy)phenyl]chromen-2-yl] hydrogen carbonate Traditional Name: carbonic acid [4-keto-3-methoxy-8-[2-(4-phenylbutoxy)phenyl]chromen-2-yl] ester Formula: C27H24O7 MolecularWeight: 460.47526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(OC2=C(C1=O)C=CC=C2C3=CC=CC=C3OCCCCC4=CC=CC=C4)OC(=O)O

Isomeric SMILES

COC1=C(OC2=C(C1=O)C=CC=C2C3=CC=CC=C3OCCCCC4=CC=CC=C4)OC(=O)O

InChI

InChI=1S/C27H24O7/c1-31-25-23(28)21-15-9-14-20(24(21)33-26(25)34-27(29)30)19-13-5-6-16-22(19)32-17-8-7-12-18-10-3-2-4-11-18/h2-6,9-11,13-16H,7-8,12,17H2,1H3,(H,29,30)