(2S)-2-(prop-2-enoxycarbonylamino)-3-(triphenylmethyl)sulfanyl-propanoic acid

Systemtic Name: (2S)-2-(prop-2-enoxycarbonylamino)-3-(triphenylmethyl)sulfanyl-propanoic acid Openeye Name: (2S)-2-(allyloxycarbonylamino)-3-tritylsulfanyl-propanoic acid CAS Name: (2S)-2-[[oxo(prop-2-enoxy)methyl]amino]-3-[(triphenylmethyl)thio]propanoic acid IUPAC Name: (2S)-2-(prop-2-enoxycarbonylamino)-3-tritylsulfanylpropanoic acid Traditional Name: (2S)-2-(allyloxycarbonylamino)-3-(tritylthio)propionic acid Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C=CCOC(=O)N[C@H](CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H25NO4S/c1-2-18-31-25(30)27-23(24(28)29)19-32-26(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h2-17,23H,1,18-19H2,(H,27,30)(H,28,29)/t23-/m1/s1