[[4-[[(E)-3-phenylprop-2-enoyl]diazenyl]phenyl]amino] pyridine-3-carboxylate

Systemtic Name: [[4-[[(E)-3-phenylprop-2-enoyl]diazenyl]phenyl]amino] pyridine-3-carboxylate Openeye Name: [4-[(E)-3-phenylprop-2-enoyl]azoanilino] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[(E)-1-oxo-3-phenylprop-2-enyl]azoanilino] ester IUPAC Name: [4-[[(E)-3-phenylprop-2-enoyl]diazenyl]anilino] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(E)-3-phenylacryloyl]azoanilino] ester Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)N=NC2=CC=C(C=C2)NOC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H16N4O3/c26-20(13-8-16-5-2-1-3-6-16)24-23-18-9-11-19(12-10-18)25-28-21(27)17-7-4-14-22-15-17/h1-15,25H/b13-8+,24-23?