methyl 3-oxidanyl-3-(4-oxidanylidene-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)pentanoate

Systemtic Name: methyl 3-oxidanyl-3-(4-oxidanylidene-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)pentanoate Openeye Name: methyl 3-hydroxy-3-(4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)pentanoate CAS Name: 3-hydroxy-3-(4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)pentanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-3-(4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)pentanoate Traditional Name: 3-hydroxy-3-(4-keto-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)valeric acid methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)OC)(C1=CC(=O)C2=NC3=C4CCC=CN4C=C3C=C2C1)O

Isomeric SMILES

CCC(CC(=O)OC)(C1=CC(=O)C2=NC3=C4CCC=CN4C=C3C=C2C1)O

InChI

InChI=1S/C21H22N2O4/c1-3-21(26,11-18(25)27-2)15-9-13-8-14-12-23-7-5-4-6-16(23)19(14)22-20(13)17(24)10-15/h5,7-8,10,12,26H,3-4,6,9,11H2,1-2H3