4-chloranyl-2-[(Z)-[[(2R)-1-methoxypropan-2-yl]carbamothioylhydrazinylidene]methyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[(Z)-[[(2R)-1-methoxypropan-2-yl]carbamothioylhydrazinylidene]methyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[(Z)-[[(1R)-2-methoxy-1-methyl-ethyl]carbamothioylhydrazono]methyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[(Z)-[[[[(2R)-1-methoxypropan-2-yl]amino]-sulfanylidenemethyl]hydrazinylidene]methyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[(Z)-[[(2R)-1-methoxypropan-2-yl]carbamothioylhydrazinylidene]methyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[(Z)-[[(1R)-2-methoxy-1-methyl-ethyl]thiocarbamoylhydrazono]methyl]-6-nitro-phenolate Formula: C12H14ClN4O4S- MolecularWeight: 345.78196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=S)NN=CC1=CC(=CC(=C1[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C[C@H](COC)NC(=S)N/N=C\C1=CC(=CC(=C1[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C12H15ClN4O4S/c1-7(6-21-2)15-12(22)16-14-5-8-3-9(13)4-10(11(8)18)17(19)20/h3-5,7,18H,6H2,1-2H3,(H2,15,16,22)/p-1/b14-5-/t7-/m1/s1