[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate

Systemtic Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Openeye Name: [5-(2-furyl)isoxazol-3-yl]methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propanoic acid [5-(2-furanyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propionic acid [5-(2-furyl)isoxazol-3-yl]methyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCC3=NOC(=C3)C4=CC=CO4

Isomeric SMILES

CC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)OCC3=NOC(=C3)C4=CC=CO4

InChI

InChI=1S/C21H19N3O5/c1-13(25)23-18(9-14-11-22-17-6-3-2-5-16(14)17)21(26)28-12-15-10-20(29-24-15)19-7-4-8-27-19/h2-8,10-11,18,22H,9,12H2,1H3,(H,23,25)/t18-/m0/s1