6-[1-(1H-imidazol-5-yl)-1-phenyl-ethyl]-3-methyl-1-oxidanidyl-4-phenyl-3,4-dihydroquinolin-1-ium

Systemtic Name: 6-[1-(1H-imidazol-5-yl)-1-phenyl-ethyl]-3-methyl-1-oxidanidyl-4-phenyl-3,4-dihydroquinolin-1-ium Openeye Name: 6-[1-(1H-imidazol-5-yl)-1-phenyl-ethyl]-3-methyl-1-oxido-4-phenyl-3,4-dihydroquinolin-1-ium CAS Name: 6-[1-(1H-imidazol-5-yl)-1-phenylethyl]-3-methyl-1-oxido-4-phenyl-3,4-dihydroquinolin-1-ium IUPAC Name: 6-[1-(1H-imidazol-5-yl)-1-phenylethyl]-3-methyl-1-oxido-4-phenyl-3,4-dihydroquinolin-1-ium Traditional Name: 6-[1-(1H-imidazol-5-yl)-1-phenyl-ethyl]-3-methyl-1-oxido-4-phenyl-3,4-dihydroquinolin-1-ium Formula: C27H25N3O MolecularWeight: 407.5069

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=[N+](C2=C(C1C3=CC=CC=C3)C=C(C=C2)C(C)(C4=CC=CC=C4)C5=CN=CN5)[O-]

Isomeric SMILES

CC1C=[N+](C2=C(C1C3=CC=CC=C3)C=C(C=C2)C(C)(C4=CC=CC=C4)C5=CN=CN5)[O-]

InChI

InChI=1S/C27H25N3O/c1-19-17-30(31)24-14-13-22(15-23(24)26(19)20-9-5-3-6-10-20)27(2,25-16-28-18-29-25)21-11-7-4-8-12-21/h3-19,26H,1-2H3,(H,28,29)