O3-ethyl O5-methyl 4-cyclohexyl-2-[(3-methoxy-3-oxidanylidene-prop-1-en-2-yl)sulfanylmethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-methyl 4-cyclohexyl-2-[(3-methoxy-3-oxidanylidene-prop-1-en-2-yl)sulfanylmethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-methyl 4-cyclohexyl-2-(1-methoxycarbonylvinylsulfanylmethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-cyclohexyl-2-[[(3-methoxy-3-oxoprop-1-en-2-yl)thio]methyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester IUPAC Name: 3-O-ethyl 5-O-methyl 4-cyclohexyl-2-[(3-methoxy-3-oxoprop-1-en-2-yl)sulfanylmethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[(1-carbomethoxyvinylthio)methyl]-4-cyclohexyl-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester Formula: C22H31NO6S MolecularWeight: 437.54964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2CCCCC2)C(=O)OC)C)CSC(=C)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2CCCCC2)C(=O)OC)C)CSC(=C)C(=O)OC

InChI

InChI=1S/C22H31NO6S/c1-6-29-22(26)19-16(12-30-14(3)20(24)27-4)23-13(2)17(21(25)28-5)18(19)15-10-8-7-9-11-15/h15,18,23H,3,6-12H2,1-2,4-5H3