[[3-(4-methylphenoxy)sulfinyloxyphenyl]carbamoylamino] 4-methylbenzenesulfinate

Systemtic Name: [[3-(4-methylphenoxy)sulfinyloxyphenyl]carbamoylamino] 4-methylbenzenesulfinate Openeye Name: [[3-(4-methylphenoxy)sulfinyloxyphenyl]carbamoylamino] 4-methylbenzenesulfinate CAS Name: 4-methylbenzenesulfinic acid [[[3-(4-methylphenoxy)sulfinyloxyanilino]-oxomethyl]amino] ester IUPAC Name: [[3-(4-methylphenoxy)sulfinyloxyphenyl]carbamoylamino] 4-methylbenzenesulfinate Traditional Name: 4-methylbenzenesulfinic acid [[3-(4-methylphenoxy)sulfinyloxyphenyl]carbamoylamino] ester Formula: C21H20N2O6S2 MolecularWeight: 460.5233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)OC2=CC=CC(=C2)NC(=O)NOS(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)OC2=CC=CC(=C2)NC(=O)NOS(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H20N2O6S2/c1-15-6-10-18(11-7-15)27-31(26)28-19-5-3-4-17(14-19)22-21(24)23-29-30(25)20-12-8-16(2)9-13-20/h3-14H,1-2H3,(H2,22,23,24)