4-[[5-[3-(4-bromophenyl)carbonyl-1-methyl-4-naphthalen-1-yl-pyrrol-1-ium-1-yl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[3-(4-bromophenyl)carbonyl-1-methyl-4-naphthalen-1-yl-pyrrol-1-ium-1-yl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[3-(4-bromobenzoyl)-1-methyl-4-(1-naphthyl)pyrrol-1-ium-1-yl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[3-[(4-bromophenyl)-oxomethyl]-1-methyl-4-(1-naphthalenyl)-1-pyrrol-1-iumyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[3-(4-bromobenzoyl)-1-methyl-4-naphthalen-1-ylpyrrol-1-ium-1-yl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[3-(4-bromobenzoyl)-1-methyl-4-(1-naphthyl)pyrrol-1-ium-1-yl]imidazol-1-yl]methyl]benzonitrile Formula: C33H24BrN4O+ MolecularWeight: 572.47386

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)C3=CC=CC4=CC=CC=C43)C5=CN=CN5CC6=CC=C(C=C6)C#N

Isomeric SMILES

C[N+]1(C=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)C3=CC=CC4=CC=CC=C43)C5=CN=CN5CC6=CC=C(C=C6)C#N

InChI

InChI=1S/C33H24BrN4O/c1-38(32-18-36-22-37(32)19-24-11-9-23(17-35)10-12-24)20-30(29-8-4-6-25-5-2-3-7-28(25)29)31(21-38)33(39)26-13-15-27(34)16-14-26/h2-16,18,20-22H,19H2,1H3/q+1