4-[3-[(E)-2-imidazol-1-ylethenyl]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-[3-[(E)-2-imidazol-1-ylethenyl]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-[3-[(E)-2-imidazol-1-ylvinyl]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-[3-[(E)-2-(1-imidazolyl)ethenyl]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-[3-[(E)-2-imidazol-1-ylethenyl]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-[3-[(E)-2-imidazol-1-ylvinyl]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC=CC(=C2)C=CN3C=CN=C3)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC=CC(=C2)/C=C/N3C=CN=C3)C(=O)O

InChI

InChI=1S/C20H19N3O4/c1-12-16(19(24)25)18(17(20(26)27)13(2)22-12)15-5-3-4-14(10-15)6-8-23-9-7-21-11-23/h3-11,18,22H,1-2H3,(H,24,25)(H,26,27)/b8-6+