6-(6-cyclopropyl-4-methyl-2-oxidanylidene-5-phenylmethoxycarbonyl-1,6-dihydropyrimidin-3-yl)hexanoic acid

Systemtic Name: 6-(6-cyclopropyl-4-methyl-2-oxidanylidene-5-phenylmethoxycarbonyl-1,6-dihydropyrimidin-3-yl)hexanoic acid Openeye Name: 6-(5-benzyloxycarbonyl-6-cyclopropyl-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl)hexanoic acid CAS Name: 6-(6-cyclopropyl-4-methyl-2-oxo-5-phenylmethoxycarbonyl-1,6-dihydropyrimidin-3-yl)hexanoic acid IUPAC Name: 6-(6-cyclopropyl-4-methyl-2-oxo-5-phenylmethoxycarbonyl-1,6-dihydropyrimidin-3-yl)hexanoic acid Traditional Name: 6-(5-carbobenzoxy-6-cyclopropyl-2-keto-4-methyl-1,6-dihydropyrimidin-3-yl)hexanoic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCCCCC(=O)O)C2CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(NC(=O)N1CCCCCC(=O)O)C2CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O5/c1-15-19(21(27)29-14-16-8-4-2-5-9-16)20(17-11-12-17)23-22(28)24(15)13-7-3-6-10-18(25)26/h2,4-5,8-9,17,20H,3,6-7,10-14H2,1H3,(H,23,28)(H,25,26)