[2-chloranyl-4-(3-phenylmethoxyphenyl)sulfanyl-phenyl] butanoate

Systemtic Name: [2-chloranyl-4-(3-phenylmethoxyphenyl)sulfanyl-phenyl] butanoate Openeye Name: [4-(3-benzyloxyphenyl)sulfanyl-2-chloro-phenyl] butanoate CAS Name: butanoic acid [2-chloro-4-[(3-phenylmethoxyphenyl)thio]phenyl] ester IUPAC Name: [2-chloro-4-(3-phenylmethoxyphenyl)sulfanylphenyl] butanoate Traditional Name: butyric acid [4-[(3-benzoxyphenyl)thio]-2-chloro-phenyl] ester Formula: C23H21ClO3S MolecularWeight: 412.92904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C(C=C1)SC2=CC=CC(=C2)OCC3=CC=CC=C3)Cl

Isomeric SMILES

CCCC(=O)OC1=C(C=C(C=C1)SC2=CC=CC(=C2)OCC3=CC=CC=C3)Cl

InChI

InChI=1S/C23H21ClO3S/c1-2-7-23(25)27-22-13-12-20(15-21(22)24)28-19-11-6-10-18(14-19)26-16-17-8-4-3-5-9-17/h3-6,8-15H,2,7,16H2,1H3