4-methyl-2-[(4-nitrophenyl)methoxycarbonyl]benzenesulfinate

Systemtic Name: 4-methyl-2-[(4-nitrophenyl)methoxycarbonyl]benzenesulfinate Openeye Name: 4-methyl-2-[(4-nitrophenyl)methoxycarbonyl]benzenesulfinate CAS Name: 4-methyl-2-[(4-nitrophenyl)methoxy-oxomethyl]benzenesulfinate IUPAC Name: 4-methyl-2-[(4-nitrophenyl)methoxycarbonyl]benzenesulfinate Traditional Name: 4-methyl-2-(4-nitrobenzyl)oxycarbonyl-benzenesulfinate Formula: C15H12NO6S- MolecularWeight: 334.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)[O-])C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)[O-])C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13NO6S/c1-10-2-7-14(23(20)21)13(8-10)15(17)22-9-11-3-5-12(6-4-11)16(18)19/h2-8H,9H2,1H3,(H,20,21)/p-1