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

Systemtic Name: methyl (2S,3S)-3-methyl-2-[[5-(quinolin-6-yloxymethyl)-1,2-oxazol-3-yl]carbonylamino]pentanoate Openeye Name: methyl (2S,3S)-3-methyl-2-[[5-(6-quinolyloxymethyl)isoxazole-3-carbonyl]amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[oxo-[5-(6-quinolinyloxymethyl)-3-isoxazolyl]methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-methyl-2-[[5-(quinolin-6-yloxymethyl)-1,2-oxazole-3-carbonyl]amino]pentanoate Traditional Name: (2S,3S)-3-methyl-2-[[5-(6-quinolyloxymethyl)isoxazole-3-carbonyl]amino]valeric acid methyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O5/c1-4-13(2)19(21(26)27-3)23-20(25)18-11-16(29-24-18)12-28-15-7-8-17-14(10-15)6-5-9-22-17/h5-11,13,19H,4,12H2,1-3H3,(H,23,25)/t13-,19-/m0/s1