(2R)-3-(1H-indol-3-yl)-2-[[(5S)-1-methyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylideneamino]propanoic acid

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[[(5S)-1-methyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylideneamino]propanoic acid Openeye Name: (2R)-3-(1H-indol-3-yl)-2-[[(5S)-1-methyl-2,4,6-trioxo-hexahydropyrimidin-5-yl]methyleneamino]propanoic acid CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[(5S)-1-methyl-2,4,6-trioxo-1,3-diazinan-5-yl]methylideneamino]propanoic acid IUPAC Name: (2R)-3-(1H-indol-3-yl)-2-[[(5S)-1-methyl-2,4,6-trioxo-1,3-diazinan-5-yl]methylideneamino]propanoic acid Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[[(5S)-2,4,6-triketo-1-methyl-hexahydropyrimidin-5-yl]methyleneamino]propionic acid Formula: C17H16N4O5 MolecularWeight: 356.33274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=O)NC1=O)C=NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CN1C(=O)[C@H](C(=O)NC1=O)C=N[C@H](CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H16N4O5/c1-21-15(23)11(14(22)20-17(21)26)8-19-13(16(24)25)6-9-7-18-12-5-3-2-4-10(9)12/h2-5,7-8,11,13,18H,6H2,1H3,(H,24,25)(H,20,22,26)/t11-,13+/m0/s1