(2-chloranyl-4-cyano-phenyl) 3-[(2-methylphenyl)carbonylamino]propanoate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 3-[(2-methylphenyl)carbonylamino]propanoate Openeye Name: (2-chloro-4-cyano-phenyl) 3-[(2-methylbenzoyl)amino]propanoate CAS Name: 3-[[(2-methylphenyl)-oxomethyl]amino]propanoic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 3-[(2-methylbenzoyl)amino]propanoate Traditional Name: 3-(o-toluoylamino)propionic acid (2-chloro-4-cyano-phenyl) ester Formula: C18H15ClN2O3 MolecularWeight: 342.7763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)OC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)OC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C18H15ClN2O3/c1-12-4-2-3-5-14(12)18(23)21-9-8-17(22)24-16-7-6-13(11-20)10-15(16)19/h2-7,10H,8-9H2,1H3,(H,21,23)