5,5-bis(hydroxymethyl)-2-[4-(4-nitrophenyl)phenyl]imino-1,3-thiazol-4-olate

Systemtic Name: 5,5-bis(hydroxymethyl)-2-[4-(4-nitrophenyl)phenyl]imino-1,3-thiazol-4-olate Openeye Name: 5,5-bis(hydroxymethyl)-2-[4-(4-nitrophenyl)phenyl]imino-thiazol-4-olate CAS Name: 5,5-bis(hydroxymethyl)-2-[4-(4-nitrophenyl)phenyl]imino-4-thiazololate IUPAC Name: 5,5-bis(hydroxymethyl)-2-[4-(4-nitrophenyl)phenyl]imino-1,3-thiazol-4-olate Traditional Name: 5,5-dimethylol-2-[4-(4-nitrophenyl)phenyl]imino-3-thiazolin-4-olate Formula: C17H14N3O5S- MolecularWeight: 372.37516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])N=C3N=C(C(S3)(CO)CO)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)[N+](=O)[O-])N=C3N=C(C(S3)(CO)CO)[O-]

InChI

InChI=1S/C17H15N3O5S/c21-9-17(10-22)15(23)19-16(26-17)18-13-5-1-11(2-6-13)12-3-7-14(8-4-12)20(24)25/h1-8,21-22H,9-10H2,(H,18,19,23)/p-1