methyl 5-[(2-methylphenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(2-methylphenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(2-methylanilino)-5-oxo-pentanoate CAS Name: 5-(2-methylanilino)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(2-methylanilino)-5-oxopentanoate Traditional Name: 5-keto-5-(o-toluidino)valeric acid methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCCC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCCC(=O)OC

InChI

InChI=1S/C13H17NO3/c1-10-6-3-4-7-11(10)14-12(15)8-5-9-13(16)17-2/h3-4,6-7H,5,8-9H2,1-2H3,(H,14,15)