dimethyl-[(E)-2-[1-(4-methylphenyl)-3-nitro-6-oxidanyl-indol-2-yl]ethenyl]azanium

Systemtic Name: dimethyl-[(E)-2-[1-(4-methylphenyl)-3-nitro-6-oxidanyl-indol-2-yl]ethenyl]azanium Openeye Name: [(E)-2-[6-hydroxy-3-nitro-1-(p-tolyl)indol-2-yl]vinyl]-dimethyl-ammonium CAS Name: [(E)-2-[6-hydroxy-1-(4-methylphenyl)-3-nitro-2-indolyl]ethenyl]-dimethylammonium IUPAC Name: [(E)-2-[6-hydroxy-1-(4-methylphenyl)-3-nitroindol-2-yl]ethenyl]-dimethylazanium Traditional Name: [(E)-2-[6-hydroxy-3-nitro-1-(p-tolyl)indol-2-yl]vinyl]-dimethyl-ammonium Formula: C19H20N3O3+ MolecularWeight: 338.3804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=CC(=C3)O)C(=C2C=C[NH+](C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=CC(=C3)O)C(=C2/C=C/[NH+](C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O3/c1-13-4-6-14(7-5-13)21-17(10-11-20(2)3)19(22(24)25)16-9-8-15(23)12-18(16)21/h4-12,23H,1-3H3/p+1/b11-10+