N-[3-(2-nitroimidazol-1-yl)propyl]-10-oxidanyl-acridin-10-ium-9-amine chloride

Systemtic Name: N-[3-(2-nitroimidazol-1-yl)propyl]-10-oxidanyl-acridin-10-ium-9-amine chloride Openeye Name: 10-hydroxy-N-[3-(2-nitroimidazol-1-yl)propyl]acridin-10-ium-9-amine chloride CAS Name: 10-hydroxy-N-[3-(2-nitro-1-imidazolyl)propyl]-9-acridin-10-iumamine chloride IUPAC Name: 10-hydroxy-N-[3-(2-nitroimidazol-1-yl)propyl]acridin-10-ium-9-amine chloride Traditional Name: (10-hydroxyacridin-10-ium-9-yl)-[3-(2-nitroimidazol-1-yl)propyl]amine chloride Formula: C19H18ClN5O3 MolecularWeight: 399.83092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[N+]2O)NCCCN4C=CN=C4[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[N+]2O)NCCCN4C=CN=C4[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C19H17N5O3.ClH/c25-23-16-8-3-1-6-14(16)18(15-7-2-4-9-17(15)23)20-10-5-12-22-13-11-21-19(22)24(26)27;/h1-4,6-9,11,13,25H,5,10,12H2;1H