4-oxidanylidene-7-[3-(2-propylphenoxy)propoxy]chromene-2-carboxylic acid

Systemtic Name: 4-oxidanylidene-7-[3-(2-propylphenoxy)propoxy]chromene-2-carboxylic acid Openeye Name: 4-oxo-7-[3-(2-propylphenoxy)propoxy]chromene-2-carboxylic acid CAS Name: 4-oxo-7-[3-(2-propylphenoxy)propoxy]-1-benzopyran-2-carboxylic acid IUPAC Name: 4-oxo-7-[3-(2-propylphenoxy)propoxy]chromene-2-carboxylic acid Traditional Name: 4-keto-7-[3-(2-propylphenoxy)propoxy]chromene-2-carboxylic acid Formula: C22H22O6 MolecularWeight: 382.40648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1OCCCOC2=CC3=C(C=C2)C(=O)C=C(O3)C(=O)O

Isomeric SMILES

CCCC1=CC=CC=C1OCCCOC2=CC3=C(C=C2)C(=O)C=C(O3)C(=O)O

InChI

InChI=1S/C22H22O6/c1-2-6-15-7-3-4-8-19(15)27-12-5-11-26-16-9-10-17-18(23)14-21(22(24)25)28-20(17)13-16/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,24,25)