3-methylbutyl 7,8-dimethyl-4,5-bis(oxidanylidene)-6H-pyrano[3,2-c]quinoline-2-carboxylate

Systemtic Name: 3-methylbutyl 7,8-dimethyl-4,5-bis(oxidanylidene)-6H-pyrano[3,2-c]quinoline-2-carboxylate Openeye Name: isopentyl 7,8-dimethyl-4,5-dioxo-6H-pyrano[3,2-c]quinoline-2-carboxylate CAS Name: 7,8-dimethyl-4,5-dioxo-6H-pyrano[3,2-c]quinoline-2-carboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 7,8-dimethyl-4,5-dioxo-6H-pyrano[3,2-c]quinoline-2-carboxylate Traditional Name: 4,5-diketo-7,8-dimethyl-6H-pyrano[3,2-c]quinoline-2-carboxylic acid isoamyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C3=C(C(=O)C=C(O3)C(=O)OCCC(C)C)C(=O)N2)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C3=C(C(=O)C=C(O3)C(=O)OCCC(C)C)C(=O)N2)C

InChI

InChI=1S/C20H21NO5/c1-10(2)7-8-25-20(24)15-9-14(22)16-18(26-15)13-6-5-11(3)12(4)17(13)21-19(16)23/h5-6,9-10H,7-8H2,1-4H3,(H,21,23)