5-butan-2-yloxycarbonyl-2,6-dimethyl-4-[2-[(4-methylphenyl)methoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-butan-2-yloxycarbonyl-2,6-dimethyl-4-[2-[(4-methylphenyl)methoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-dimethyl-4-[2-(p-tolylmethoxy)phenyl]-5-sec-butoxycarbonyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-[butan-2-yloxy(oxo)methyl]-2,6-dimethyl-4-[2-[(4-methylphenyl)methoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-butan-2-yloxycarbonyl-2,6-dimethyl-4-[2-[(4-methylphenyl)methoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2,6-dimethyl-4-[2-(4-methylbenzyl)oxyphenyl]-5-sec-butoxycarbonyl-1,4-dihydropyridine-3-carboxylic acid Formula: C27H31NO5 MolecularWeight: 449.53874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=C(NC(=C(C1C2=CC=CC=C2OCC3=CC=C(C=C3)C)C(=O)O)C)C

Isomeric SMILES

CCC(C)OC(=O)C1=C(NC(=C(C1C2=CC=CC=C2OCC3=CC=C(C=C3)C)C(=O)O)C)C

InChI

InChI=1S/C27H31NO5/c1-6-17(3)33-27(31)24-19(5)28-18(4)23(26(29)30)25(24)21-9-7-8-10-22(21)32-15-20-13-11-16(2)12-14-20/h7-14,17,25,28H,6,15H2,1-5H3,(H,29,30)