2-(4,5-dimethoxy-2-nitro-phenyl)propyl phenylsulfanylmethanoate

Systemtic Name: 2-(4,5-dimethoxy-2-nitro-phenyl)propyl phenylsulfanylmethanoate Openeye Name: 2-(4,5-dimethoxy-2-nitro-phenyl)propyl phenylsulfanylformate CAS Name: (phenylthio)formic acid 2-(4,5-dimethoxy-2-nitrophenyl)propyl ester IUPAC Name: 2-(4,5-dimethoxy-2-nitrophenyl)propyl phenylsulfanylformate Traditional Name: (phenylthio)formic acid 2-(4,5-dimethoxy-2-nitro-phenyl)propyl ester Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)SC1=CC=CC=C1)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CC(COC(=O)SC1=CC=CC=C1)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H19NO6S/c1-12(11-25-18(20)26-13-7-5-4-6-8-13)14-9-16(23-2)17(24-3)10-15(14)19(21)22/h4-10,12H,11H2,1-3H3