2-[(2S)-2-acetamido-3-[[(2S)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-propyl]-4-diazonio-phenolate

Systemtic Name: 2-[(2S)-2-acetamido-3-[[(2S)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-3-oxidanylidene-propyl]-4-diazonio-phenolate Openeye Name: 2-[(2S)-2-acetamido-3-[[(1S)-2-methoxy-1-methyl-2-oxo-ethyl]amino]-3-oxo-propyl]-4-diazonio-phenolate CAS Name: 2-[(2S)-2-acetamido-3-[[(2S)-1-methoxy-1-oxopropan-2-yl]amino]-3-oxopropyl]-4-diazoniophenolate IUPAC Name: 2-[(2S)-2-acetamido-3-[[(2S)-1-methoxy-1-oxopropan-2-yl]amino]-3-oxopropyl]-4-diazoniophenolate Traditional Name: 2-[(2S)-2-acetamido-3-keto-3-[[(1S)-2-keto-2-methoxy-1-methyl-ethyl]amino]propyl]-4-diazonio-phenolate Formula: C15H18N4O5 MolecularWeight: 334.32722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C(CC1=C(C=CC(=C1)[N+]#N)[O-])NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)OC)NC(=O)[C@H](CC1=C(C=CC(=C1)[N+]#N)[O-])NC(=O)C

InChI

InChI=1S/C15H18N4O5/c1-8(15(23)24-3)17-14(22)12(18-9(2)20)7-10-6-11(19-16)4-5-13(10)21/h4-6,8,12H,7H2,1-3H3,(H2-,17,18,20,21,22)/t8-,12-/m0/s1