1-[5-(2-benzamidoethyl)imidazol-1-yl]propyl-dimethyl-(2-phenoxyethyl)azanium

Systemtic Name: 1-[5-(2-benzamidoethyl)imidazol-1-yl]propyl-dimethyl-(2-phenoxyethyl)azanium Openeye Name: 1-[5-(2-benzamidoethyl)imidazol-1-yl]propyl-dimethyl-(2-phenoxyethyl)ammonium CAS Name: 1-[5-(2-benzamidoethyl)-1-imidazolyl]propyl-dimethyl-(2-phenoxyethyl)ammonium IUPAC Name: 1-[5-(2-benzamidoethyl)imidazol-1-yl]propyl-dimethyl-(2-phenoxyethyl)azanium Traditional Name: 1-[5-(2-benzamidoethyl)imidazol-1-yl]propyl-dimethyl-(2-phenoxyethyl)ammonium Formula: C25H33N4O2+ MolecularWeight: 421.55512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1C=NC=C1CCNC(=O)C2=CC=CC=C2)[N+](C)(C)CCOC3=CC=CC=C3

Isomeric SMILES

CCC(N1C=NC=C1CCNC(=O)C2=CC=CC=C2)[N+](C)(C)CCOC3=CC=CC=C3

InChI

InChI=1S/C25H32N4O2/c1-4-24(29(2,3)17-18-31-23-13-9-6-10-14-23)28-20-26-19-22(28)15-16-27-25(30)21-11-7-5-8-12-21/h5-14,19-20,24H,4,15-18H2,1-3H3/p+1