3-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide

Systemtic Name: 3-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide Openeye Name: 3-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide CAS Name: 3-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide IUPAC Name: 3-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide Traditional Name: 3-nitro-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide Formula: C21H16N4O3S MolecularWeight: 404.44174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC3=C(C=C2)SC4=CC=CC=C4N3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=CC=C1)[N+](=O)[O-])/C2=CC3=C(C=C2)SC4=CC=CC=C4N3

InChI

InChI=1S/C21H16N4O3S/c1-13(23-24-21(26)15-5-4-6-16(11-15)25(27)28)14-9-10-20-18(12-14)22-17-7-2-3-8-19(17)29-20/h2-12,22H,1H3,(H,24,26)/b23-13+