2-(2-azanylbenzo[e][1,3]benzothiazol-1-ium-1-yl)-N-naphthalen-1-yl-ethanamide chloride

Systemtic Name: 2-(2-azanylbenzo[e][1,3]benzothiazol-1-ium-1-yl)-N-naphthalen-1-yl-ethanamide chloride Openeye Name: 2-(2-aminobenzo[e][1,3]benzothiazol-1-ium-1-yl)-N-(1-naphthyl)acetamide chloride CAS Name: 2-(2-amino-1-benzo[e][1,3]benzothiazol-1-iumyl)-N-(1-naphthalenyl)acetamide chloride IUPAC Name: 2-(2-aminobenzo[e][1,3]benzothiazol-1-ium-1-yl)-N-naphthalen-1-ylacetamide chloride Traditional Name: 2-(2-aminobenzo[e][1,3]benzothiazol-1-ium-1-yl)-N-(1-naphthyl)acetamide chloride Formula: C23H18ClN3OS MolecularWeight: 419.92652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)C[N+]3=C(SC4=C3C5=CC=CC=C5C=C4)N.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)C[N+]3=C(SC4=C3C5=CC=CC=C5C=C4)N.[Cl-]

InChI

InChI=1S/C23H17N3OS.ClH/c24-23-26(22-18-10-4-2-7-16(18)12-13-20(22)28-23)14-21(27)25-19-11-5-8-15-6-1-3-9-17(15)19;/h1-13,24H,14H2,(H,25,27);1H