sodium (Z)-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]prop-2-enoate

Systemtic Name: sodium (Z)-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]prop-2-enoate Openeye Name: sodium (Z)-2-methyl-3-[4-(3-pyridylmethyl)phenyl]prop-2-enoate CAS Name: sodium (Z)-2-methyl-3-[4-(3-pyridinylmethyl)phenyl]-2-propenoate IUPAC Name: sodium (Z)-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]prop-2-enoate Traditional Name: sodium (Z)-2-methyl-3-[4-(3-pyridylmethyl)phenyl]acrylate Formula: C16H14NNaO2 MolecularWeight: 275.27763

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)CC2=CN=CC=C2)C(=O)[O-].[Na+]

Isomeric SMILES

C/C(=C/C1=CC=C(C=C1)CC2=CN=CC=C2)/C(=O)[O-].[Na+]

InChI

InChI=1S/C16H15NO2.Na/c1-12(16(18)19)9-13-4-6-14(7-5-13)10-15-3-2-8-17-11-15;/h2-9,11H,10H2,1H3,(H,18,19);/q;+1/p-1/b12-9-;