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

Systemtic Name: tert-butyl 3-(7-methyl-4-oxidanylidene-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)-3-oxidanyl-pentanoate Openeye Name: tert-butyl 3-hydroxy-3-(7-methyl-4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)pentanoate CAS Name: 3-hydroxy-3-(7-methyl-4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-hydroxy-3-(7-methyl-4-oxo-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)pentanoate Traditional Name: 3-hydroxy-3-(4-keto-7-methyl-6,7-dihydro-1H-indolizino[1,2-b]quinolin-2-yl)valeric acid tert-butyl ester Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)OC(C)(C)C)(C1=CC(=O)C2=NC3=C4CC(C=CN4C=C3C=C2C1)C)O

Isomeric SMILES

CCC(CC(=O)OC(C)(C)C)(C1=CC(=O)C2=NC3=C4CC(C=CN4C=C3C=C2C1)C)O

InChI

InChI=1S/C25H30N2O4/c1-6-25(30,13-21(29)31-24(3,4)5)18-11-16-10-17-14-27-8-7-15(2)9-19(27)22(17)26-23(16)20(28)12-18/h7-8,10,12,14-15,30H,6,9,11,13H2,1-5H3