2-[(4-methoxycarbonylphenyl)methyl]benzenecarbothioic S-acid

Systemtic Name: 2-[(4-methoxycarbonylphenyl)methyl]benzenecarbothioic S-acid Openeye Name: 2-[(4-methoxycarbonylphenyl)methyl]benzenecarbothioic S-acid CAS Name: 2-[(4-methoxycarbonylphenyl)methyl]benzenecarbothioic S-acid IUPAC Name: 2-[(4-methoxycarbonylphenyl)methyl]benzenecarbothioic S-acid Traditional Name: 2-(4-carbomethoxybenzyl)thiobenzoic acid Formula: C16H14O3S MolecularWeight: 286.34556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CC2=CC=CC=C2C(=O)S

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CC2=CC=CC=C2C(=O)S

InChI

InChI=1S/C16H14O3S/c1-19-15(17)12-8-6-11(7-9-12)10-13-4-2-3-5-14(13)16(18)20/h2-9H,10H2,1H3,(H,18,20)