ethyl 3-[6-chloranyl-4-methyl-2-oxidanylidene-7-[2-oxidanylidene-2-(4-pyrrolidin-1-ylphenyl)ethoxy]chromen-3-yl]propanoate

Systemtic Name: ethyl 3-[6-chloranyl-4-methyl-2-oxidanylidene-7-[2-oxidanylidene-2-(4-pyrrolidin-1-ylphenyl)ethoxy]chromen-3-yl]propanoate Openeye Name: ethyl 3-[6-chloro-4-methyl-2-oxo-7-[2-oxo-2-(4-pyrrolidin-1-ylphenyl)ethoxy]chromen-3-yl]propanoate CAS Name: 3-[6-chloro-4-methyl-2-oxo-7-[2-oxo-2-[4-(1-pyrrolidinyl)phenyl]ethoxy]-1-benzopyran-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[6-chloro-4-methyl-2-oxo-7-[2-oxo-2-(4-pyrrolidin-1-ylphenyl)ethoxy]chromen-3-yl]propanoate Traditional Name: 3-[6-chloro-2-keto-7-[2-keto-2-(4-pyrrolidinophenyl)ethoxy]-4-methyl-chromen-3-yl]propionic acid ethyl ester Formula: C27H28ClNO6 MolecularWeight: 497.96732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC(=O)C3=CC=C(C=C3)N4CCCC4)Cl)C

Isomeric SMILES

CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC(=O)C3=CC=C(C=C3)N4CCCC4)Cl)C

InChI

InChI=1S/C27H28ClNO6/c1-3-33-26(31)11-10-20-17(2)21-14-22(28)25(15-24(21)35-27(20)32)34-16-23(30)18-6-8-19(9-7-18)29-12-4-5-13-29/h6-9,14-15H,3-5,10-13,16H2,1-2H3