[2-methoxy-6-[(E)-2-nitroethenyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-methoxy-6-[(E)-2-nitroethenyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-methoxy-6-[(E)-2-nitrovinyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methoxy-6-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-methoxy-6-[(E)-2-nitroethenyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-methoxy-6-[(E)-2-nitrovinyl]phenyl] ester Formula: C16H15NO6S MolecularWeight: 349.3584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2OC)C=C[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2OC)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C16H15NO6S/c1-12-6-8-14(9-7-12)24(20,21)23-16-13(10-11-17(18)19)4-3-5-15(16)22-2/h3-11H,1-2H3/b11-10+