phenyl 2-sulfanylidene-3H-1,3-benzoxazole-6-carboxylate

Systemtic Name: phenyl 2-sulfanylidene-3H-1,3-benzoxazole-6-carboxylate Openeye Name: phenyl 2-thioxo-3H-1,3-benzoxazole-6-carboxylate CAS Name: 2-sulfanylidene-3H-1,3-benzoxazole-6-carboxylic acid phenyl ester IUPAC Name: phenyl 2-sulfanylidene-3H-1,3-benzoxazole-6-carboxylate Traditional Name: 2-thioxo-3H-1,3-benzoxazole-6-carboxylic acid phenyl ester Formula: C14H9NO3S MolecularWeight: 271.29116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)NC(=S)O3

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=CC3=C(C=C2)NC(=S)O3

InChI

InChI=1S/C14H9NO3S/c16-13(17-10-4-2-1-3-5-10)9-6-7-11-12(8-9)18-14(19)15-11/h1-8H,(H,15,19)