10-(2-dimethylaminoethyl)-7-nitro-5,5-bis(oxidanylidene)phenothiazin-3-ol

Systemtic Name: 10-(2-dimethylaminoethyl)-7-nitro-5,5-bis(oxidanylidene)phenothiazin-3-ol Openeye Name: 10-(2-dimethylaminoethyl)-7-nitro-5,5-dioxo-phenothiazin-3-ol CAS Name: 10-(2-dimethylaminoethyl)-7-nitro-5,5-dioxo-3-phenothiazinol IUPAC Name: 10-(2-dimethylaminoethyl)-7-nitro-5,5-dioxophenothiazin-3-ol Traditional Name: 10-(2-dimethylaminoethyl)-5,5-diketo-7-nitro-phenothiazin-3-ol Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=C1C=CC(=C3)O

Isomeric SMILES

CN(C)CCN1C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=C1C=CC(=C3)O

InChI

InChI=1S/C16H17N3O5S/c1-17(2)7-8-18-13-5-3-11(19(21)22)9-15(13)25(23,24)16-10-12(20)4-6-14(16)18/h3-6,9-10,20H,7-8H2,1-2H3