[2-(2-methylphenoxy)propanoylamino] 4-methylbenzenesulfinate

Systemtic Name: [2-(2-methylphenoxy)propanoylamino] 4-methylbenzenesulfinate Openeye Name: [2-(2-methylphenoxy)propanoylamino] 4-methylbenzenesulfinate CAS Name: 4-methylbenzenesulfinic acid [[2-(2-methylphenoxy)-1-oxopropyl]amino] ester IUPAC Name: [2-(2-methylphenoxy)propanoylamino] 4-methylbenzenesulfinate Traditional Name: 4-methylbenzenesulfinic acid [2-(2-methylphenoxy)propanoylamino] ester Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)ONC(=O)C(C)OC2=CC=CC=C2C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)ONC(=O)C(C)OC2=CC=CC=C2C

InChI

InChI=1S/C17H19NO4S/c1-12-8-10-15(11-9-12)23(20)22-18-17(19)14(3)21-16-7-5-4-6-13(16)2/h4-11,14H,1-3H3,(H,18,19)