propan-2-yl 4-methyl-3-(4-nitrophenoxy)benzenesulfonate

Systemtic Name: propan-2-yl 4-methyl-3-(4-nitrophenoxy)benzenesulfonate Openeye Name: isopropyl 4-methyl-3-(4-nitrophenoxy)benzenesulfonate CAS Name: 4-methyl-3-(4-nitrophenoxy)benzenesulfonic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-3-(4-nitrophenoxy)benzenesulfonate Traditional Name: 4-methyl-3-(4-nitrophenoxy)benzenesulfonic acid isopropyl ester Formula: C16H17NO6S MolecularWeight: 351.37428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC(C)C)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC(C)C)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17NO6S/c1-11(2)23-24(20,21)15-9-4-12(3)16(10-15)22-14-7-5-13(6-8-14)17(18)19/h4-11H,1-3H3