methyl 4-[(2-phenylphenyl)methylsulfonyl]butanoate hydrochloride

Systemtic Name: methyl 4-[(2-phenylphenyl)methylsulfonyl]butanoate hydrochloride Openeye Name: methyl 4-[(2-phenylphenyl)methylsulfonyl]butanoate hydrochloride CAS Name: 4-[(2-phenylphenyl)methylsulfonyl]butanoic acid methyl ester hydrochloride IUPAC Name: methyl 4-[(2-phenylphenyl)methylsulfonyl]butanoate hydrochloride Traditional Name: 4-(2-phenylbenzyl)sulfonylbutyric acid methyl ester hydrochloride Formula: C18H21ClO4S MolecularWeight: 368.87494

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCS(=O)(=O)CC1=CC=CC=C1C2=CC=CC=C2.Cl

Isomeric SMILES

COC(=O)CCCS(=O)(=O)CC1=CC=CC=C1C2=CC=CC=C2.Cl

InChI

InChI=1S/C18H20O4S.ClH/c1-22-18(19)12-7-13-23(20,21)14-16-10-5-6-11-17(16)15-8-3-2-4-9-15;/h2-6,8-11H,7,12-14H2,1H3;1H