[2,3,4-triacetyloxy-6-[[2-(4-methylphenyl)-4-oxidanylidene-quinazolin-3-yl]amino]-5-oxidanylidene-hexyl] ethanoate

Systemtic Name: [2,3,4-triacetyloxy-6-[[2-(4-methylphenyl)-4-oxidanylidene-quinazolin-3-yl]amino]-5-oxidanylidene-hexyl] ethanoate Openeye Name: [2,3,4-triacetoxy-5-oxo-6-[[4-oxo-2-(p-tolyl)quinazolin-3-yl]amino]hexyl] acetate CAS Name: acetic acid [2,3,4-triacetyloxy-6-[[2-(4-methylphenyl)-4-oxo-3-quinazolinyl]amino]-5-oxohexyl] ester IUPAC Name: [2,3,4-triacetyloxy-6-[[2-(4-methylphenyl)-4-oxoquinazolin-3-yl]amino]-5-oxohexyl] acetate Traditional Name: acetic acid [2,3,4-triacetoxy-5-keto-6-[[4-keto-2-(p-tolyl)quinazolin-3-yl]amino]hexyl] ester Formula: C29H31N3O10 MolecularWeight: 581.57054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NCC(=O)C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NCC(=O)C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C29H31N3O10/c1-16-10-12-21(13-11-16)28-31-23-9-7-6-8-22(23)29(38)32(28)30-14-24(37)26(41-19(4)35)27(42-20(5)36)25(40-18(3)34)15-39-17(2)33/h6-13,25-27,30H,14-15H2,1-5H3