5-(3-methylbutoxy)-4-oxidanylidene-6-prop-2-enyl-chromene-2-carboxylic acid

Systemtic Name: 5-(3-methylbutoxy)-4-oxidanylidene-6-prop-2-enyl-chromene-2-carboxylic acid Openeye Name: 6-allyl-5-isopentyloxy-4-oxo-chromene-2-carboxylic acid CAS Name: 5-(3-methylbutoxy)-4-oxo-6-prop-2-enyl-1-benzopyran-2-carboxylic acid IUPAC Name: 5-(3-methylbutoxy)-4-oxo-6-prop-2-enylchromene-2-carboxylic acid Traditional Name: 6-allyl-5-isoamoxy-4-keto-chromene-2-carboxylic acid Formula: C18H20O5 MolecularWeight: 316.3484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=CC2=C1C(=O)C=C(O2)C(=O)O)CC=C

Isomeric SMILES

CC(C)CCOC1=C(C=CC2=C1C(=O)C=C(O2)C(=O)O)CC=C

InChI

InChI=1S/C18H20O5/c1-4-5-12-6-7-14-16(17(12)22-9-8-11(2)3)13(19)10-15(23-14)18(20)21/h4,6-7,10-11H,1,5,8-9H2,2-3H3,(H,20,21)