N-(5-chloranyl-2-methyl-phenyl)-2-(1-oxidanylbutan-2-ylamino)ethanamide; ethanedioic acid

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-(1-oxidanylbutan-2-ylamino)ethanamide; ethanedioic acid Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[1-(hydroxymethyl)propylamino]acetamide; oxalic acid CAS Name: N-(5-chloro-2-methylphenyl)-2-(1-hydroxybutan-2-ylamino)acetamide; oxalic acid IUPAC Name: N-(5-chloro-2-methylphenyl)-2-(1-hydroxybutan-2-ylamino)acetamide; oxalic acid Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-(1-methylolpropylamino)acetamide; oxalic acid Formula: C15H21ClN2O6 MolecularWeight: 360.79004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NCC(=O)NC1=C(C=CC(=C1)Cl)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(CO)NCC(=O)NC1=C(C=CC(=C1)Cl)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H19ClN2O2.C2H2O4/c1-3-11(8-17)15-7-13(18)16-12-6-10(14)5-4-9(12)2;3-1(4)2(5)6/h4-6,11,15,17H,3,7-8H2,1-2H3,(H,16,18);(H,3,4)(H,5,6)