2-(2-nitro-4-phenyl-phenyl)-2-propan-2-ylsulfanyl-ethanoic acid

Systemtic Name: 2-(2-nitro-4-phenyl-phenyl)-2-propan-2-ylsulfanyl-ethanoic acid Openeye Name: 2-isopropylsulfanyl-2-(2-nitro-4-phenyl-phenyl)acetic acid CAS Name: 2-(2-nitro-4-phenylphenyl)-2-(propan-2-ylthio)acetic acid IUPAC Name: 2-(2-nitro-4-phenylphenyl)-2-propan-2-ylsulfanylacetic acid Traditional Name: 2-(isopropylthio)-2-(2-nitro-4-phenyl-phenyl)acetic acid Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(C1=C(C=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)SC(C1=C(C=C(C=C1)C2=CC=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H17NO4S/c1-11(2)23-16(17(19)20)14-9-8-13(10-15(14)18(21)22)12-6-4-3-5-7-12/h3-11,16H,1-2H3,(H,19,20)