(2S)-2-[[(Z)-1-(5-chloranyl-2-oxidanidyl-phenyl)-3-oxidanylidene-prop-1-en-2-yl]azaniumyl]propanoate

Systemtic Name: (2S)-2-[[(Z)-1-(5-chloranyl-2-oxidanidyl-phenyl)-3-oxidanylidene-prop-1-en-2-yl]azaniumyl]propanoate Openeye Name: (2S)-2-[[(Z)-2-(5-chloro-2-oxido-phenyl)-1-formyl-vinyl]ammonio]propanoate CAS Name: (2S)-2-[[(Z)-1-(5-chloro-2-oxidophenyl)-3-oxoprop-1-en-2-yl]ammonio]propanoate IUPAC Name: (2S)-2-[[(Z)-1-(5-chloro-2-oxidophenyl)-3-oxoprop-1-en-2-yl]azaniumyl]propanoate Traditional Name: (2S)-2-[[(Z)-2-(5-chloro-2-oxido-phenyl)-1-formyl-vinyl]ammonio]propionate Formula: C12H11ClNO4- MolecularWeight: 268.67304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH2+]C(=CC1=C(C=CC(=C1)Cl)[O-])C=O

Isomeric SMILES

C[C@@H](C(=O)[O-])[NH2+]/C(=C\C1=C(C=CC(=C1)Cl)[O-])/C=O

InChI

InChI=1S/C12H12ClNO4/c1-7(12(17)18)14-10(6-15)5-8-4-9(13)2-3-11(8)16/h2-7,14,16H,1H3,(H,17,18)/p-1/b10-5-/t7-/m0/s1