8,13-bis(oxidanylidene)-14H-naphtho[2,3-a]phenothiazin-14-ium-7-olate

Systemtic Name: 8,13-bis(oxidanylidene)-14H-naphtho[2,3-a]phenothiazin-14-ium-7-olate Openeye Name: 8,13-dioxo-14H-naphtho[2,3-a]phenothiazin-14-ium-7-olate CAS Name: 8,13-dioxo-14H-naphtho[2,3-a]phenothiazin-14-ium-7-olate IUPAC Name: 8,13-dioxo-14H-naphtho[2,3-a]phenothiazin-14-ium-7-olate Traditional Name: 8,13-diketo-14H-naphtho[2,3-a]phenothiazin-14-ium-7-olate Formula: C20H11NO3S MolecularWeight: 345.37124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3[O-])SC5=CC=CC=C5[NH2+]4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C4=C(C=C3[O-])SC5=CC=CC=C5[NH2+]4

InChI

InChI=1S/C20H11NO3S/c22-13-9-15-18(21-12-7-3-4-8-14(12)25-15)17-16(13)19(23)10-5-1-2-6-11(10)20(17)24/h1-9,21-22H