6-(hydroxymethyl)-5-methoxycarbonyl-2-methyl-4-(2-phenylphenyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 6-(hydroxymethyl)-5-methoxycarbonyl-2-methyl-4-(2-phenylphenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 6-(hydroxymethyl)-5-methoxycarbonyl-2-methyl-4-(2-phenylphenyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 6-(hydroxymethyl)-5-methoxycarbonyl-2-methyl-4-(2-phenylphenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 6-(hydroxymethyl)-5-methoxycarbonyl-2-methyl-4-(2-phenylphenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-2-methyl-6-methylol-4-(2-phenylphenyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CO)C(=O)OC)C2=CC=CC=C2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)CO)C(=O)OC)C2=CC=CC=C2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H21NO5/c1-13-18(21(25)26)19(20(22(27)28-2)17(12-24)23-13)16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-11,19,23-24H,12H2,1-2H3,(H,25,26)