methyl (2S)-2-[[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[5-(2-methoxyphenyl)isoxazole-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[5-(2-methoxyphenyl)-3-isoxazolyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-(2-methoxyphenyl)-1,2-oxazole-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[5-(2-methoxyphenyl)isoxazole-3-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NO2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NO2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H20N2O5/c1-26-18-11-7-6-10-15(18)19-13-16(23-28-19)20(24)22-17(21(25)27-2)12-14-8-4-3-5-9-14/h3-11,13,17H,12H2,1-2H3,(H,22,24)/t17-/m0/s1