quinolin-8-ylmethyl (2S)-3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate

Systemtic Name: quinolin-8-ylmethyl (2S)-3-methyl-2-[(3-methylphenyl)carbonylamino]butanoate Openeye Name: 8-quinolylmethyl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl (2S)-3-methyl-2-[(3-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(m-toluoylamino)butyric acid 8-quinolylmethyl ester Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C(C)C)C(=O)OCC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)OCC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C23H24N2O3/c1-15(2)20(25-22(26)18-9-4-7-16(3)13-18)23(27)28-14-19-10-5-8-17-11-6-12-24-21(17)19/h4-13,15,20H,14H2,1-3H3,(H,25,26)/t20-/m0/s1