(4-nitrophenyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(triphenylmethyl)sulfanyl-propanoate

Systemtic Name: (4-nitrophenyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(triphenylmethyl)sulfanyl-propanoate Openeye Name: (4-nitrophenyl) (2S)-2-(tert-butoxycarbonylamino)-3-tritylsulfanyl-propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(triphenylmethyl)thio]propanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-tritylsulfanylpropanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(tritylthio)propionic acid (4-nitrophenyl) ester Formula: C33H32N2O6S MolecularWeight: 584.68198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C33H32N2O6S/c1-32(2,3)41-31(37)34-29(30(36)40-28-21-19-27(20-22-28)35(38)39)23-42-33(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-22,29H,23H2,1-3H3,(H,34,37)/t29-/m1/s1