2,6-dimethyl-4-[2-[(Z)-2-methyl-3-octoxy-3-oxidanylidene-prop-1-enyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2,6-dimethyl-4-[2-[(Z)-2-methyl-3-octoxy-3-oxidanylidene-prop-1-enyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2,6-dimethyl-4-[2-[(Z)-2-methyl-3-octoxy-3-oxo-prop-1-enyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2,6-dimethyl-4-[2-[(Z)-2-methyl-3-octoxy-3-oxoprop-1-enyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2,6-dimethyl-4-[2-[(Z)-2-methyl-3-octoxy-3-oxoprop-1-enyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-[2-[(Z)-3-keto-2-methyl-3-octoxy-prop-1-enyl]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C27H35NO6 MolecularWeight: 469.5699

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(=CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)O)C)C)C(=O)O)C

Isomeric SMILES

CCCCCCCCOC(=O)/C(=C\C1=CC=CC=C1C2C(=C(NC(=C2C(=O)O)C)C)C(=O)O)/C

InChI

InChI=1S/C27H35NO6/c1-5-6-7-8-9-12-15-34-27(33)17(2)16-20-13-10-11-14-21(20)24-22(25(29)30)18(3)28-19(4)23(24)26(31)32/h10-11,13-14,16,24,28H,5-9,12,15H2,1-4H3,(H,29,30)(H,31,32)/b17-16-