[2-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenyl] 2-chloranylpyridine-3-carboxylate

Systemtic Name: [2-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenyl] 2-chloranylpyridine-3-carboxylate Openeye Name: [2-[(3-oxobenzothiophen-2-ylidene)methyl]phenyl] 2-chloropyridine-3-carboxylate CAS Name: 2-chloro-3-pyridinecarboxylic acid [2-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] ester IUPAC Name: [2-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] 2-chloropyridine-3-carboxylate Traditional Name: 2-chloronicotinic acid [2-[(3-ketobenzothiophen-2-ylidene)methyl]phenyl] ester Formula: C21H12ClNO3S MolecularWeight: 393.84288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)C3=CC=CC=C3S2)OC(=O)C4=C(N=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C=C2C(=O)C3=CC=CC=C3S2)OC(=O)C4=C(N=CC=C4)Cl

InChI

InChI=1S/C21H12ClNO3S/c22-20-15(8-5-11-23-20)21(25)26-16-9-3-1-6-13(16)12-18-19(24)14-7-2-4-10-17(14)27-18/h1-12H