[7-chloranyl-3-methoxy-5,8-bis(oxidanylidene)naphthalen-1-yl] 4-methylbenzenesulfonate

Systemtic Name: [7-chloranyl-3-methoxy-5,8-bis(oxidanylidene)naphthalen-1-yl] 4-methylbenzenesulfonate Openeye Name: (7-chloro-3-methoxy-5,8-dioxo-1-naphthyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-chloro-3-methoxy-5,8-dioxo-1-naphthalenyl) ester IUPAC Name: (7-chloro-3-methoxy-5,8-dioxonaphthalen-1-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (7-chloro-5,8-diketo-3-methoxy-1-naphthyl) ester Formula: C18H13ClO6S MolecularWeight: 392.81022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC(=C2)OC)C(=O)C=C(C3=O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC(=C2)OC)C(=O)C=C(C3=O)Cl

InChI

InChI=1S/C18H13ClO6S/c1-10-3-5-12(6-4-10)26(22,23)25-16-8-11(24-2)7-13-15(20)9-14(19)18(21)17(13)16/h3-9H,1-2H3