3-(chloromethylsulfanyl)-2-[(triphenylmethyl)amino]propanoic acid

Systemtic Name: 3-(chloromethylsulfanyl)-2-[(triphenylmethyl)amino]propanoic acid Openeye Name: 3-(chloromethylsulfanyl)-2-(tritylamino)propanoic acid CAS Name: 3-(chloromethylthio)-2-[(triphenylmethyl)amino]propanoic acid IUPAC Name: 3-(chloromethylsulfanyl)-2-(tritylamino)propanoic acid Traditional Name: 3-(chloromethylthio)-2-(tritylamino)propionic acid Formula: C23H22ClNO2S MolecularWeight: 411.94428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(CSCCl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(CSCCl)C(=O)O

InChI

InChI=1S/C23H22ClNO2S/c24-17-28-16-21(22(26)27)25-23(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21,25H,16-17H2,(H,26,27)