methyl (2R)-3-(1H-indol-3-yl)-2-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[1-oxo-2-(4-oxo-3-quinazolinyl)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[[2-(4-ketoquinazolin-3-yl)acetyl]amino]propionic acid methyl ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H20N4O4/c1-30-22(29)19(10-14-11-23-17-8-4-2-6-15(14)17)25-20(27)12-26-13-24-18-9-5-3-7-16(18)21(26)28/h2-9,11,13,19,23H,10,12H2,1H3,(H,25,27)/t19-/m1/s1