6-[(E)-1-(4-chlorophenyl)-3-(dimethylamino)prop-2-enyl]pyridine-2-carboxylic acid

Systemtic Name: 6-[(E)-1-(4-chlorophenyl)-3-(dimethylamino)prop-2-enyl]pyridine-2-carboxylic acid Openeye Name: 6-[(E)-1-(4-chlorophenyl)-3-(dimethylamino)allyl]pyridine-2-carboxylic acid CAS Name: 6-[(E)-1-(4-chlorophenyl)-3-(dimethylamino)prop-2-enyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[(E)-1-(4-chlorophenyl)-3-(dimethylamino)prop-2-enyl]pyridine-2-carboxylic acid Traditional Name: 6-[(E)-1-(4-chlorophenyl)-3-(dimethylamino)allyl]picolinic acid Formula: C17H17ClN2O2 MolecularWeight: 316.78208

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=CC(C1=CC=C(C=C1)Cl)C2=CC=CC(=N2)C(=O)O

Isomeric SMILES

CN(C)/C=C/C(C1=CC=C(C=C1)Cl)C2=CC=CC(=N2)C(=O)O

InChI

InChI=1S/C17H17ClN2O2/c1-20(2)11-10-14(12-6-8-13(18)9-7-12)15-4-3-5-16(19-15)17(21)22/h3-11,14H,1-2H3,(H,21,22)/b11-10+