5-[(E)-2-[2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]ethenyl]pyridine-3-carboxylic acid

Systemtic Name: 5-[(E)-2-[2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]ethenyl]pyridine-3-carboxylic acid Openeye Name: 5-[(E)-2-[2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]vinyl]pyridine-3-carboxylic acid CAS Name: 5-[(E)-2-[2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]ethenyl]-3-pyridinecarboxylic acid IUPAC Name: 5-[(E)-2-[2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]ethenyl]pyridine-3-carboxylic acid Traditional Name: 5-[(E)-2-[2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]vinyl]nicotinic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C=CC2=CC(=CN=C2)C(=O)O)C)OC(=O)NC

Isomeric SMILES

CC1=CC(=CC(=C1/C=C/C2=CC(=CN=C2)C(=O)O)C)OC(=O)NC

InChI

InChI=1S/C18H18N2O4/c1-11-6-15(24-18(23)19-3)7-12(2)16(11)5-4-13-8-14(17(21)22)10-20-9-13/h4-10H,1-3H3,(H,19,23)(H,21,22)/b5-4+