[(2R,3S,4S)-2,3,4-triacetyloxy-5-[7,8-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-b]quinolin-10-yl]pentyl] ethanoate

Systemtic Name: [(2R,3S,4S)-2,3,4-triacetyloxy-5-[7,8-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-b]quinolin-10-yl]pentyl] ethanoate Openeye Name: [(2R,3S,4S)-2,3,4-triacetoxy-5-(7,8-dimethyl-2,4-dioxo-pyrimido[4,5-b]quinolin-10-yl)pentyl] acetate CAS Name: acetic acid [(2R,3S,4S)-2,3,4-triacetyloxy-5-(7,8-dimethyl-2,4-dioxo-10-pyrimido[4,5-b]quinolinyl)pentyl] ester IUPAC Name: [(2R,3S,4S)-2,3,4-triacetyloxy-5-(7,8-dimethyl-2,4-dioxopyrimido[4,5-b]quinolin-10-yl)pentyl] acetate Traditional Name: acetic acid [(2R,3S,4S)-2,3,4-triacetoxy-5-(2,4-diketo-7,8-dimethyl-pyrimido[4,5-b]quinolin-10-yl)pentyl] ester Formula: C26H29N3O10 MolecularWeight: 543.52256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C3C(=O)NC(=O)N=C3N2CC(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C3C(=O)NC(=O)N=C3N2C[C@@H]([C@@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C

InChI

InChI=1S/C26H29N3O10/c1-12-7-18-9-19-24(27-26(35)28-25(19)34)29(20(18)8-13(12)2)10-21(37-15(4)31)23(39-17(6)33)22(38-16(5)32)11-36-14(3)30/h7-9,21-23H,10-11H2,1-6H3,(H,28,34,35)/t21-,22+,23-/m0/s1