(E)-4-[[3-[(1S)-1-morpholin-4-yl-2-oxidanidyl-2-oxidanylidene-ethyl]-1H-indol-5-yl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[3-[(1S)-1-morpholin-4-yl-2-oxidanidyl-2-oxidanylidene-ethyl]-1H-indol-5-yl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[[3-[(1S)-1-morpholino-2-oxido-2-oxo-ethyl]-1H-indol-5-yl]amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[3-[(1S)-1-(4-morpholinyl)-2-oxido-2-oxoethyl]-1H-indol-5-yl]amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[[3-[(1S)-1-morpholin-4-yl-2-oxido-2-oxoethyl]-1H-indol-5-yl]amino]-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-[[3-[(1S)-2-keto-1-morpholino-2-oxido-ethyl]-1H-indol-5-yl]amino]but-2-enoate Formula: C18H17N3O6-2 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(C2=CNC3=C2C=C(C=C3)NC(=O)C=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1COCCN1[C@@H](C2=CNC3=C2C=C(C=C3)NC(=O)/C=C/C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H19N3O6/c22-15(3-4-16(23)24)20-11-1-2-14-12(9-11)13(10-19-14)17(18(25)26)21-5-7-27-8-6-21/h1-4,9-10,17,19H,5-8H2,(H,20,22)(H,23,24)(H,25,26)/p-2/b4-3+/t17-/m0/s1