(4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-(quinolin-2-ylmethyl)azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-(quinolin-2-ylmethyl)azanium Openeye Name: (4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-(2-quinolylmethyl)ammonium CAS Name: (4-dimethylaminophenyl)methyl-[3-(1-imidazolyl)propyl]-(2-quinolinylmethyl)ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-(3-imidazol-1-ylpropyl)-(quinolin-2-ylmethyl)azanium Traditional Name: [4-(dimethylamino)benzyl]-(3-imidazol-1-ylpropyl)-(2-quinolylmethyl)ammonium Formula: C25H30N5+ MolecularWeight: 400.5392

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C[NH+](CCCN2C=CN=C2)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C[NH+](CCCN2C=CN=C2)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H29N5/c1-28(2)24-12-8-21(9-13-24)18-30(16-5-15-29-17-14-26-20-29)19-23-11-10-22-6-3-4-7-25(22)27-23/h3-4,6-14,17,20H,5,15-16,18-19H2,1-2H3/p+1