2-[[3,3-dimethyl-2-(4-phenylphenyl)indol-1-ium-1-yl]methyl]-4-nitro-phenol

Systemtic Name: 2-[[3,3-dimethyl-2-(4-phenylphenyl)indol-1-ium-1-yl]methyl]-4-nitro-phenol Openeye Name: 2-[[3,3-dimethyl-2-(4-phenylphenyl)indol-1-ium-1-yl]methyl]-4-nitro-phenol CAS Name: 2-[[3,3-dimethyl-2-(4-phenylphenyl)-1-indol-1-iumyl]methyl]-4-nitrophenol IUPAC Name: 2-[[3,3-dimethyl-2-(4-phenylphenyl)indol-1-ium-1-yl]methyl]-4-nitrophenol Traditional Name: 2-[[3,3-dimethyl-2-(4-phenylphenyl)indol-1-ium-1-yl]methyl]-4-nitro-phenol Formula: C29H25N2O3+ MolecularWeight: 449.5204

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2[N+](=C1C3=CC=C(C=C3)C4=CC=CC=C4)CC5=C(C=CC(=C5)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(C2=CC=CC=C2[N+](=C1C3=CC=C(C=C3)C4=CC=CC=C4)CC5=C(C=CC(=C5)[N+](=O)[O-])O)C

InChI

InChI=1S/C29H24N2O3/c1-29(2)25-10-6-7-11-26(25)30(19-23-18-24(31(33)34)16-17-27(23)32)28(29)22-14-12-21(13-15-22)20-8-4-3-5-9-20/h3-18H,19H2,1-2H3/p+1