2-[2-azanylidene-3-[3-(3-methylphenoxy)-2-oxidanyl-propyl]benzimidazol-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2-azanylidene-3-[3-(3-methylphenoxy)-2-oxidanyl-propyl]benzimidazol-1-yl]ethyl-diethyl-azanium Openeye Name: diethyl-[2-[3-[2-hydroxy-3-(3-methylphenoxy)propyl]-2-imino-benzimidazol-1-yl]ethyl]ammonium CAS Name: diethyl-[2-[3-[2-hydroxy-3-(3-methylphenoxy)propyl]-2-imino-1-benzimidazolyl]ethyl]ammonium IUPAC Name: diethyl-[2-[3-[2-hydroxy-3-(3-methylphenoxy)propyl]-2-iminobenzimidazol-1-yl]ethyl]azanium Traditional Name: diethyl-[2-[3-[2-hydroxy-3-(3-methylphenoxy)propyl]-2-imino-benzimidazol-1-yl]ethyl]ammonium Formula: C23H33N4O2+ MolecularWeight: 397.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N(C1=N)CC(COC3=CC=CC(=C3)C)O

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N(C1=N)CC(COC3=CC=CC(=C3)C)O

InChI

InChI=1S/C23H32N4O2/c1-4-25(5-2)13-14-26-21-11-6-7-12-22(21)27(23(26)24)16-19(28)17-29-20-10-8-9-18(3)15-20/h6-12,15,19,24,28H,4-5,13-14,16-17H2,1-3H3/p+1