(2-methanoyl-6-methoxy-3-nitro-phenyl) 4-methylbenzenesulfonate

Systemtic Name: (2-methanoyl-6-methoxy-3-nitro-phenyl) 4-methylbenzenesulfonate Openeye Name: (2-formyl-6-methoxy-3-nitro-phenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-formyl-6-methoxy-3-nitrophenyl) ester IUPAC Name: (2-formyl-6-methoxy-3-nitrophenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-formyl-6-methoxy-3-nitro-phenyl) ester Formula: C15H13NO7S MolecularWeight: 351.33122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2C=O)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2C=O)[N+](=O)[O-])OC

InChI

InChI=1S/C15H13NO7S/c1-10-3-5-11(6-4-10)24(20,21)23-15-12(9-17)13(16(18)19)7-8-14(15)22-2/h3-9H,1-2H3