4-[4-(1,3-benzodioxol-5-yl)phenyl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[4-(1,3-benzodioxol-5-yl)phenyl]-4-oxidanylidene-butanoate Openeye Name: 4-[4-(1,3-benzodioxol-5-yl)phenyl]-4-oxo-butanoate CAS Name: 4-[4-(1,3-benzodioxol-5-yl)phenyl]-4-oxobutanoate IUPAC Name: 4-[4-(1,3-benzodioxol-5-yl)phenyl]-4-oxobutanoate Traditional Name: 4-[4-(1,3-benzodioxol-5-yl)phenyl]-4-keto-butyrate Formula: C17H13O5- MolecularWeight: 297.28212

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC=C(C=C3)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC=C(C=C3)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C17H14O5/c18-14(6-8-17(19)20)12-3-1-11(2-4-12)13-5-7-15-16(9-13)22-10-21-15/h1-5,7,9H,6,8,10H2,(H,19,20)/p-1