2-[(Z)-1-(1,3-benzodioxol-5-yl)-3-methoxy-3-oxidanylidene-prop-1-en-2-yl]benzoic acid

Systemtic Name: 2-[(Z)-1-(1,3-benzodioxol-5-yl)-3-methoxy-3-oxidanylidene-prop-1-en-2-yl]benzoic acid Openeye Name: 2-[(Z)-2-(1,3-benzodioxol-5-yl)-1-methoxycarbonyl-vinyl]benzoic acid CAS Name: 2-[(Z)-1-(1,3-benzodioxol-5-yl)-3-methoxy-3-oxoprop-1-en-2-yl]benzoic acid IUPAC Name: 2-[(Z)-1-(1,3-benzodioxol-5-yl)-3-methoxy-3-oxoprop-1-en-2-yl]benzoic acid Traditional Name: 2-[(Z)-2-(1,3-benzodioxol-5-yl)-1-carbomethoxy-vinyl]benzoic acid Formula: C18H14O6 MolecularWeight: 326.30016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC2=C(C=C1)OCO2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

COC(=O)/C(=C\C1=CC2=C(C=C1)OCO2)/C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H14O6/c1-22-18(21)14(12-4-2-3-5-13(12)17(19)20)8-11-6-7-15-16(9-11)24-10-23-15/h2-9H,10H2,1H3,(H,19,20)/b14-8-