[(2R,3S)-5-(4-azanyl-2-oxidanylidene-pyridin-1-yl)-3-(4-methylphenyl)carbonyloxy-oxolan-2-yl]methyl 4-methylbenzoate

Systemtic Name: [(2R,3S)-5-(4-azanyl-2-oxidanylidene-pyridin-1-yl)-3-(4-methylphenyl)carbonyloxy-oxolan-2-yl]methyl 4-methylbenzoate Openeye Name: [(2R,3S)-5-(4-amino-2-oxo-1-pyridyl)-3-(4-methylbenzoyl)oxy-tetrahydrofuran-2-yl]methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(2R,3S)-5-(4-amino-2-oxo-1-pyridinyl)-3-[(4-methylphenyl)-oxomethoxy]-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S)-5-(4-amino-2-oxopyridin-1-yl)-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(2R,3S)-5-(4-amino-2-keto-1-pyridyl)-3-p-toluoyloxy-tetrahydrofuran-2-yl]methyl ester Formula: C26H26N2O6 MolecularWeight: 462.49444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC2C(CC(O2)N3C=CC(=CC3=O)N)OC(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC[C@@H]2[C@H](CC(O2)N3C=CC(=CC3=O)N)OC(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H26N2O6/c1-16-3-7-18(8-4-16)25(30)32-15-22-21(34-26(31)19-9-5-17(2)6-10-19)14-24(33-22)28-12-11-20(27)13-23(28)29/h3-13,21-22,24H,14-15,27H2,1-2H3/t21-,22+,24?/m0/s1