4-[1-phenyl-1-[(E)-3-phenylprop-2-enoyl]oxy-propan-2-yl]pyridine-3-carboxylate chloride

Systemtic Name: 4-[1-phenyl-1-[(E)-3-phenylprop-2-enoyl]oxy-propan-2-yl]pyridine-3-carboxylate chloride Openeye Name: 4-[1-methyl-2-phenyl-2-[(E)-3-phenylprop-2-enoyl]oxy-ethyl]pyridine-3-carboxylate chloride CAS Name: 4-[1-[(E)-1-oxo-3-phenylprop-2-enoxy]-1-phenylpropan-2-yl]-3-pyridinecarboxylate chloride IUPAC Name: 4-[1-phenyl-1-[(E)-3-phenylprop-2-enoyl]oxypropan-2-yl]pyridine-3-carboxylate chloride Traditional Name: 4-[1-methyl-2-phenyl-2-[(E)-3-phenylacryloyl]oxy-ethyl]nicotinate chloride Formula: C24H20ClNO4-2 MolecularWeight: 421.8729

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=NC=C1)C(=O)[O-])C(C2=CC=CC=C2)OC(=O)C=CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC(C1=C(C=NC=C1)C(=O)[O-])C(C2=CC=CC=C2)OC(=O)/C=C/C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C24H21NO4.ClH/c1-17(20-14-15-25-16-21(20)24(27)28)23(19-10-6-3-7-11-19)29-22(26)13-12-18-8-4-2-5-9-18;/h2-17,23H,1H3,(H,27,28);1H/p-2/b13-12+;