3-(2-cyanophenothiazin-10-yl)propyl hydrogen sulfate

Systemtic Name: 3-(2-cyanophenothiazin-10-yl)propyl hydrogen sulfate Openeye Name: 3-(2-cyanophenothiazin-10-yl)propyl hydrogen sulfate CAS Name: sulfuric acid 3-(2-cyano-10-phenothiazinyl)propyl ester IUPAC Name: 3-(2-cyanophenothiazin-10-yl)propyl hydrogen sulfate Traditional Name: sulfuric acid 3-(2-cyanophenothiazin-10-yl)propyl ester Formula: C16H14N2O4S2 MolecularWeight: 362.42336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)C#N)CCCOS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)C#N)CCCOS(=O)(=O)O

InChI

InChI=1S/C16H14N2O4S2/c17-11-12-6-7-16-14(10-12)18(8-3-9-22-24(19,20)21)13-4-1-2-5-15(13)23-16/h1-2,4-7,10H,3,8-9H2,(H,19,20,21)