2,6-dimethyl-4-[2-[[(E)-pent-2-enoyl]amino]phenyl]pyridine-3,5-dicarboxylic acid

Systemtic Name: 2,6-dimethyl-4-[2-[[(E)-pent-2-enoyl]amino]phenyl]pyridine-3,5-dicarboxylic acid Openeye Name: 2,6-dimethyl-4-[2-[[(E)-pent-2-enoyl]amino]phenyl]pyridine-3,5-dicarboxylic acid CAS Name: 2,6-dimethyl-4-[2-[[(E)-1-oxopent-2-enyl]amino]phenyl]pyridine-3,5-dicarboxylic acid IUPAC Name: 2,6-dimethyl-4-[2-[[(E)-pent-2-enoyl]amino]phenyl]pyridine-3,5-dicarboxylic acid Traditional Name: 2,6-dimethyl-4-[2-[[(E)-pent-2-enoyl]amino]phenyl]dinicotinic acid Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(=O)NC1=CC=CC=C1C2=C(C(=NC(=C2C(=O)O)C)C)C(=O)O

Isomeric SMILES

CC/C=C/C(=O)NC1=CC=CC=C1C2=C(C(=NC(=C2C(=O)O)C)C)C(=O)O

InChI

InChI=1S/C20H20N2O5/c1-4-5-10-15(23)22-14-9-7-6-8-13(14)18-16(19(24)25)11(2)21-12(3)17(18)20(26)27/h5-10H,4H2,1-3H3,(H,22,23)(H,24,25)(H,26,27)/b10-5+