(3-methylquinoxalin-2-yl)methyl 3-[(3-methylphenyl)carbonylamino]propanoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 3-[(3-methylphenyl)carbonylamino]propanoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 3-[(3-methylbenzoyl)amino]propanoate CAS Name: 3-[[(3-methylphenyl)-oxomethyl]amino]propanoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 3-[(3-methylbenzoyl)amino]propanoate Traditional Name: 3-(m-toluoylamino)propionic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCC(=O)OCC2=NC3=CC=CC=C3N=C2C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCC(=O)OCC2=NC3=CC=CC=C3N=C2C

InChI

InChI=1S/C21H21N3O3/c1-14-6-5-7-16(12-14)21(26)22-11-10-20(25)27-13-19-15(2)23-17-8-3-4-9-18(17)24-19/h3-9,12H,10-11,13H2,1-2H3,(H,22,26)