3-[(3-oxidanylidene-6-pentoxy-1,2-dihydroinden-5-yl)oxymethyl]benzoic acid

Systemtic Name: 3-[(3-oxidanylidene-6-pentoxy-1,2-dihydroinden-5-yl)oxymethyl]benzoic acid Openeye Name: 3-[(3-oxo-6-pentoxy-indan-5-yl)oxymethyl]benzoic acid CAS Name: 3-[(3-oxo-6-pentoxy-1,2-dihydroinden-5-yl)oxymethyl]benzoic acid IUPAC Name: 3-[(3-oxo-6-pentoxy-1,2-dihydroinden-5-yl)oxymethyl]benzoic acid Traditional Name: 3-[(6-amoxy-3-keto-indan-5-yl)oxymethyl]benzoic acid Formula: C22H24O5 MolecularWeight: 368.42296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C2C(=C1)CCC2=O)OCC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CCCCCOC1=C(C=C2C(=C1)CCC2=O)OCC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C22H24O5/c1-2-3-4-10-26-20-12-16-8-9-19(23)18(16)13-21(20)27-14-15-6-5-7-17(11-15)22(24)25/h5-7,11-13H,2-4,8-10,14H2,1H3,(H,24,25)