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名称: benzyl 4-(3-amino-4-phenylphenyl)butyrate tosylate

IUPAC: benzyl 4-(3-amino-4-phenylphenyl)butanoate;4-methylbenzenesulfonic acid

SMILES: Cc1ccc(S(=O)(=O)O)cc1.Nc1cc(CCCC(=O)OCc2ccccc2)ccc1-c1ccccc1

Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CCCC2=CC(=C(C=C2)C3=CC=CC=C3)N

分子式: C30H31NO5S

分子量: 517.60

InChIKey: RJSYTJHIHXPRLT-UHFFFAOYSA-N

InChI: InChI=1S/C23H23NO2.C7H8O3S/c24-22-16-18(14-15-21(22)20-11-5-2-6-12-20)10-7-13-23(25)26-17-19-8-3-1-4-9-19;1-6-2-4-7(5-3-6)11(8,9)10/h1-6,8-9,11-12,14-16H,7,10,13,17,24H2;2-5H,1H3,(H,8,9,10)

PubChem CID: 87066192 →

同義語

SCHEMBL99024RJSYTJHIHXPRLT-UHFFFAOYSA-Nbenzyl 4-(3-amino-4-phenylphenyl)butyrate tosylate

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