5-[3,3-bis(oxidanyl)prop-2-enoyl]-3-butoxycarbonyl-3,4-dihydronaphthalene-1-carboxylic acid

Systemtic Name: 5-[3,3-bis(oxidanyl)prop-2-enoyl]-3-butoxycarbonyl-3,4-dihydronaphthalene-1-carboxylic acid Openeye Name: 3-butoxycarbonyl-5-(3,3-dihydroxyprop-2-enoyl)-3,4-dihydronaphthalene-1-carboxylic acid CAS Name: 3-[butoxy(oxo)methyl]-5-(3,3-dihydroxy-1-oxoprop-2-enyl)-3,4-dihydronaphthalene-1-carboxylic acid IUPAC Name: 3-butoxycarbonyl-5-(3,3-dihydroxyprop-2-enoyl)-3,4-dihydronaphthalene-1-carboxylic acid Traditional Name: 3-butoxycarbonyl-5-(3,3-dihydroxyacryloyl)-3,4-dihydronaphthalene-1-carboxylic acid Formula: C19H20O7 MolecularWeight: 360.3579

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CC2=C(C=CC=C2C(=O)C=C(O)O)C(=C1)C(=O)O

Isomeric SMILES

CCCCOC(=O)C1CC2=C(C=CC=C2C(=O)C=C(O)O)C(=C1)C(=O)O

InChI

InChI=1S/C19H20O7/c1-2-3-7-26-19(25)11-8-14-12(15(9-11)18(23)24)5-4-6-13(14)16(20)10-17(21)22/h4-6,9-11,21-22H,2-3,7-8H2,1H3,(H,23,24)