5-[ethyl-(2-methylphenyl)amino]pentanoate

Systemtic Name: 5-[ethyl-(2-methylphenyl)amino]pentanoate Openeye Name: 5-(N-ethyl-2-methyl-anilino)pentanoate CAS Name: 5-(N-ethyl-2-methylanilino)pentanoate IUPAC Name: 5-(N-ethyl-2-methylanilino)pentanoate Traditional Name: 5-(N-ethyl-2-methyl-anilino)valerate Formula: C14H20NO2- MolecularWeight: 234.3141

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCC(=O)[O-])C1=CC=CC=C1C

Isomeric SMILES

CCN(CCCCC(=O)[O-])C1=CC=CC=C1C

InChI

InChI=1S/C14H21NO2/c1-3-15(11-7-6-10-14(16)17)13-9-5-4-8-12(13)2/h4-5,8-9H,3,6-7,10-11H2,1-2H3,(H,16,17)/p-1