methyl (2S)-3-methyl-2-[[5-(quinolin-6-yloxymethyl)-1,2-oxazol-3-yl]carbonylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[5-(quinolin-6-yloxymethyl)-1,2-oxazol-3-yl]carbonylamino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[[5-(6-quinolyloxymethyl)isoxazole-3-carbonyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[oxo-[5-(6-quinolinyloxymethyl)-3-isoxazolyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[5-(quinolin-6-yloxymethyl)-1,2-oxazole-3-carbonyl]amino]butanoate Traditional Name: (2S)-3-methyl-2-[[5-(6-quinolyloxymethyl)isoxazole-3-carbonyl]amino]butyric acid methyl ester Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=NOC(=C1)COC2=CC3=C(C=C2)N=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)C1=NOC(=C1)COC2=CC3=C(C=C2)N=CC=C3

InChI

InChI=1S/C20H21N3O5/c1-12(2)18(20(25)26-3)22-19(24)17-10-15(28-23-17)11-27-14-6-7-16-13(9-14)5-4-8-21-16/h4-10,12,18H,11H2,1-3H3,(H,22,24)/t18-/m0/s1