4-[[4-(3-methylphenyl)-2-oxidanylidene-6-propyl-3,4-dihydro-1H-pyrimidin-5-yl]carbonyloxymethyl]benzoic acid

Systemtic Name: 4-[[4-(3-methylphenyl)-2-oxidanylidene-6-propyl-3,4-dihydro-1H-pyrimidin-5-yl]carbonyloxymethyl]benzoic acid Openeye Name: 4-[[4-(m-tolyl)-2-oxo-6-propyl-3,4-dihydro-1H-pyrimidine-5-carbonyl]oxymethyl]benzoic acid CAS Name: 4-[[[4-(3-methylphenyl)-2-oxo-6-propyl-3,4-dihydro-1H-pyrimidin-5-yl]-oxomethoxy]methyl]benzoic acid IUPAC Name: 4-[[4-(3-methylphenyl)-2-oxo-6-propyl-3,4-dihydro-1H-pyrimidine-5-carbonyl]oxymethyl]benzoic acid Traditional Name: 4-[[2-keto-4-(m-tolyl)-6-propyl-3,4-dihydro-1H-pyrimidine-5-carbonyl]oxymethyl]benzoic acid Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(NC(=O)N1)C2=CC(=CC=C2)C)C(=O)OCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCC1=C(C(NC(=O)N1)C2=CC(=CC=C2)C)C(=O)OCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H24N2O5/c1-3-5-18-19(20(25-23(29)24-18)17-7-4-6-14(2)12-17)22(28)30-13-15-8-10-16(11-9-15)21(26)27/h4,6-12,20H,3,5,13H2,1-2H3,(H,26,27)(H2,24,25,29)