3-[(4-chlorophenyl)methyl]benzenecarbothioic S-acid

Systemtic Name: 3-[(4-chlorophenyl)methyl]benzenecarbothioic S-acid Openeye Name: 3-[(4-chlorophenyl)methyl]benzenecarbothioic S-acid CAS Name: 3-[(4-chlorophenyl)methyl]benzenecarbothioic S-acid IUPAC Name: 3-[(4-chlorophenyl)methyl]benzenecarbothioic S-acid Traditional Name: 3-(4-chlorobenzyl)thiobenzoic acid Formula: C14H11ClOS MolecularWeight: 262.75454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC2=CC=C(C=C2)Cl)C(=O)S

Isomeric SMILES

C1=CC(=CC(=C1)CC2=CC=C(C=C2)Cl)C(=O)S

InChI

InChI=1S/C14H11ClOS/c15-13-6-4-10(5-7-13)8-11-2-1-3-12(9-11)14(16)17/h1-7,9H,8H2,(H,16,17)