[1-(6-methoxynaphthalen-2-yl)-1-oxidanylidene-propan-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-(6-methoxynaphthalen-2-yl)-1-oxidanylidene-propan-2-yl] 4-methylbenzenesulfonate Openeye Name: [2-(6-methoxy-2-naphthyl)-1-methyl-2-oxo-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-(6-methoxy-2-naphthalenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(6-methoxynaphthalen-2-yl)-1-oxopropan-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-keto-2-(6-methoxy-2-naphthyl)-1-methyl-ethyl] ester Formula: C21H20O5S MolecularWeight: 384.4455

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(=O)C2=CC3=C(C=C2)C=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C(=O)C2=CC3=C(C=C2)C=C(C=C3)OC

InChI

InChI=1S/C21H20O5S/c1-14-4-10-20(11-5-14)27(23,24)26-15(2)21(22)18-7-6-17-13-19(25-3)9-8-16(17)12-18/h4-13,15H,1-3H3