methyl (2R)-3-(1H-indol-3-yl)-2-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]propionic acid methyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)CCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H23N3O5/c1-30-22(28)18(13-15-14-24-17-8-3-2-7-16(15)17)25-21(27)11-6-12-26-19-9-4-5-10-20(19)31-23(26)29/h2-5,7-10,14,18,24H,6,11-13H2,1H3,(H,25,27)/t18-/m1/s1