dimethyl-[(2-methyl-3-nitro-6-oxidanyl-1-phenyl-indol-7-yl)methyl]azanium chloride

Systemtic Name: dimethyl-[(2-methyl-3-nitro-6-oxidanyl-1-phenyl-indol-7-yl)methyl]azanium chloride Openeye Name: (6-hydroxy-2-methyl-3-nitro-1-phenyl-indol-7-yl)methyl-dimethyl-ammonium chloride CAS Name: (6-hydroxy-2-methyl-3-nitro-1-phenyl-7-indolyl)methyl-dimethylammonium chloride IUPAC Name: (6-hydroxy-2-methyl-3-nitro-1-phenylindol-7-yl)methyl-dimethylazanium chloride Traditional Name: (6-hydroxy-2-methyl-3-nitro-1-phenyl-indol-7-yl)methyl-dimethyl-ammonium chloride Formula: C18H20ClN3O3 MolecularWeight: 361.8227

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=CC=C3)C(=C(C=C2)O)C[NH+](C)C)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=CC=C3)C(=C(C=C2)O)C[NH+](C)C)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C18H19N3O3.ClH/c1-12-17(21(23)24)14-9-10-16(22)15(11-19(2)3)18(14)20(12)13-7-5-4-6-8-13;/h4-10,22H,11H2,1-3H3;1H