(3-methylphenyl)methyl 5-azanyl-4-oxidanylidene-pentanoate hydrochloride

Systemtic Name: (3-methylphenyl)methyl 5-azanyl-4-oxidanylidene-pentanoate hydrochloride Openeye Name: m-tolylmethyl 5-amino-4-oxo-pentanoate hydrochloride CAS Name: 5-amino-4-oxopentanoic acid (3-methylphenyl)methyl ester hydrochloride IUPAC Name: (3-methylphenyl)methyl 5-amino-4-oxopentanoate hydrochloride Traditional Name: 5-amino-4-keto-valeric acid (3-methylbenzyl) ester hydrochloride Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)CCC(=O)CN.Cl

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)CCC(=O)CN.Cl

InChI

InChI=1S/C13H17NO3.ClH/c1-10-3-2-4-11(7-10)9-17-13(16)6-5-12(15)8-14;/h2-4,7H,5-6,8-9,14H2,1H3;1H