diethyl 2-oxidanyl-2-(5-oxidanylidene-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl)propanedioate

Systemtic Name: diethyl 2-oxidanyl-2-(5-oxidanylidene-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl)propanedioate Openeye Name: diethyl 2-hydroxy-2-(5-oxo-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl)propanedioate CAS Name: 2-hydroxy-2-(5-oxo-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-hydroxy-2-(5-oxo-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl)propanedioate Traditional Name: 2-hydroxy-2-(5-keto-6,7,8,9-tetrahydrobenzocyclohepten-6-yl)malonic acid diethyl ester Formula: C18H22O6 MolecularWeight: 334.36368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CCCC2=CC=CC=C2C1=O)(C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C(C1CCCC2=CC=CC=C2C1=O)(C(=O)OCC)O

InChI

InChI=1S/C18H22O6/c1-3-23-16(20)18(22,17(21)24-4-2)14-11-7-9-12-8-5-6-10-13(12)15(14)19/h5-6,8,10,14,22H,3-4,7,9,11H2,1-2H3