ethyl 6-chloranyl-3-(2-methoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-4-phenyl-4H-chromene-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-3-(2-methoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-4-phenyl-4H-chromene-3-carboxylate Openeye Name: ethyl 6-chloro-3-(2-methoxy-2-oxo-ethyl)-2-oxo-4-phenyl-chromane-3-carboxylate CAS Name: 6-chloro-3-(2-methoxy-2-oxoethyl)-2-oxo-4-phenyl-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-3-(2-methoxy-2-oxoethyl)-2-oxo-4-phenyl-4H-chromene-3-carboxylate Traditional Name: 6-chloro-2-keto-3-(2-keto-2-methoxy-ethyl)-4-phenyl-chroman-3-carboxylic acid ethyl ester Formula: C21H19ClO6 MolecularWeight: 402.82496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C2=C(C=CC(=C2)Cl)OC1=O)C3=CC=CC=C3)CC(=O)OC

Isomeric SMILES

CCOC(=O)C1(C(C2=C(C=CC(=C2)Cl)OC1=O)C3=CC=CC=C3)CC(=O)OC

InChI

InChI=1S/C21H19ClO6/c1-3-27-19(24)21(12-17(23)26-2)18(13-7-5-4-6-8-13)15-11-14(22)9-10-16(15)28-20(21)25/h4-11,18H,3,12H2,1-2H3