methyl 5-[(3-chloranyl-4-methyl-phenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(3-chloranyl-4-methyl-phenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(3-chloro-4-methyl-anilino)-5-oxo-pentanoate CAS Name: 5-(3-chloro-4-methylanilino)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(3-chloro-4-methylanilino)-5-oxopentanoate Traditional Name: 5-(3-chloro-4-methyl-anilino)-5-keto-valeric acid methyl ester Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCC(=O)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCC(=O)OC)Cl

InChI

InChI=1S/C13H16ClNO3/c1-9-6-7-10(8-11(9)14)15-12(16)4-3-5-13(17)18-2/h6-8H,3-5H2,1-2H3,(H,15,16)