2-[2-methoxy-5-[2-[(2-nitrophenyl)disulfanyl]propanoyl]phenyl]ethanoic acid

Systemtic Name: 2-[2-methoxy-5-[2-[(2-nitrophenyl)disulfanyl]propanoyl]phenyl]ethanoic acid Openeye Name: 2-[2-methoxy-5-[2-[(2-nitrophenyl)disulfanyl]propanoyl]phenyl]acetic acid CAS Name: 2-[2-methoxy-5-[2-[(2-nitrophenyl)disulfanyl]-1-oxopropyl]phenyl]acetic acid IUPAC Name: 2-[2-methoxy-5-[2-[(2-nitrophenyl)disulfanyl]propanoyl]phenyl]acetic acid Traditional Name: 2-[2-methoxy-5-[2-[(2-nitrophenyl)disulfanyl]propanoyl]phenyl]acetic acid Formula: C18H17NO6S2 MolecularWeight: 407.46068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=C(C=C1)OC)CC(=O)O)SSC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)C1=CC(=C(C=C1)OC)CC(=O)O)SSC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H17NO6S2/c1-11(26-27-16-6-4-3-5-14(16)19(23)24)18(22)12-7-8-15(25-2)13(9-12)10-17(20)21/h3-9,11H,10H2,1-2H3,(H,20,21)