2-[5-chloranyl-2-ethoxy-4-[(4S)-5-ethoxycarbonyl-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]ethanoate

Systemtic Name: 2-[5-chloranyl-2-ethoxy-4-[(4S)-5-ethoxycarbonyl-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]ethanoate Openeye Name: 2-[5-chloro-2-ethoxy-4-[(4S)-5-ethoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]acetate CAS Name: 2-[5-chloro-2-ethoxy-4-[(4S)-5-ethoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]acetate IUPAC Name: 2-[5-chloro-2-ethoxy-4-[(4S)-5-ethoxycarbonyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]acetate Traditional Name: 2-[4-[(4S)-5-carbethoxy-2-keto-6-methyl-3,4-dihydro-1H-pyrimidin-4-yl]-5-chloro-2-ethoxy-phenoxy]acetate Formula: C18H20ClN2O7- MolecularWeight: 411.8136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC)Cl)OCC(=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[C@@H]2C(=C(NC(=O)N2)C)C(=O)OCC)Cl)OCC(=O)[O-]

InChI

InChI=1S/C18H21ClN2O7/c1-4-26-12-6-10(11(19)7-13(12)28-8-14(22)23)16-15(17(24)27-5-2)9(3)20-18(25)21-16/h6-7,16H,4-5,8H2,1-3H3,(H,22,23)(H2,20,21,25)/p-1/t16-/m1/s1