3-cyanopropyl 2-[(2-methylphenyl)carbonylamino]ethanoate

Systemtic Name: 3-cyanopropyl 2-[(2-methylphenyl)carbonylamino]ethanoate Openeye Name: 3-cyanopropyl 2-[(2-methylbenzoyl)amino]acetate CAS Name: 2-[[(2-methylphenyl)-oxomethyl]amino]acetic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-[(2-methylbenzoyl)amino]acetate Traditional Name: 2-(o-toluoylamino)acetic acid 3-cyanopropyl ester Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC(=O)OCCCC#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC(=O)OCCCC#N

InChI

InChI=1S/C14H16N2O3/c1-11-6-2-3-7-12(11)14(18)16-10-13(17)19-9-5-4-8-15/h2-3,6-7H,4-5,9-10H2,1H3,(H,16,18)