4-(2-chlorophenyl)-5-methoxycarbonyl-2-methyl-6-[(E)-3-oxidanylprop-1-enyl]-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(2-chlorophenyl)-5-methoxycarbonyl-2-methyl-6-[(E)-3-oxidanylprop-1-enyl]-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(2-chlorophenyl)-6-[(E)-3-hydroxyprop-1-enyl]-5-methoxycarbonyl-2-methyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(2-chlorophenyl)-6-[(E)-3-hydroxyprop-1-enyl]-5-methoxycarbonyl-2-methyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(2-chlorophenyl)-6-[(E)-3-hydroxyprop-1-enyl]-5-methoxycarbonyl-2-methyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-4-(2-chlorophenyl)-6-[(E)-3-hydroxyprop-1-enyl]-2-methyl-1,4-dihydropyridine-3-carboxylic acid Formula: C18H18ClNO5 MolecularWeight: 363.79222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C=CCO)C(=O)OC)C2=CC=CC=C2Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)/C=C/CO)C(=O)OC)C2=CC=CC=C2Cl)C(=O)O

InChI

InChI=1S/C18H18ClNO5/c1-10-14(17(22)23)15(11-6-3-4-7-12(11)19)16(18(24)25-2)13(20-10)8-5-9-21/h3-8,15,20-21H,9H2,1-2H3,(H,22,23)/b8-5+