2-[(2-nitrophenyl)amino]-3-(triphenylmethyl)sulfanyl-propanoic acid

Systemtic Name: 2-[(2-nitrophenyl)amino]-3-(triphenylmethyl)sulfanyl-propanoic acid Openeye Name: 2-(2-nitroanilino)-3-tritylsulfanyl-propanoic acid CAS Name: 2-(2-nitroanilino)-3-[(triphenylmethyl)thio]propanoic acid IUPAC Name: 2-(2-nitroanilino)-3-tritylsulfanylpropanoic acid Traditional Name: 2-(2-nitroanilino)-3-(tritylthio)propionic acid Formula: C28H24N2O4S MolecularWeight: 484.56616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC(C(=O)O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCC(C(=O)O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C28H24N2O4S/c31-27(32)25(29-24-18-10-11-19-26(24)30(33)34)20-35-28(21-12-4-1-5-13-21,22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-19,25,29H,20H2,(H,31,32)