1-[1-[3-(4-phenoxybutoxy)phenyl]ethylimino]pyrrolidin-1-ium hydrochloride

Systemtic Name: 1-[1-[3-(4-phenoxybutoxy)phenyl]ethylimino]pyrrolidin-1-ium hydrochloride Openeye Name: 1-[1-[3-(4-phenoxybutoxy)phenyl]ethylimino]pyrrolidin-1-ium hydrochloride CAS Name: 1-[1-[3-(4-phenoxybutoxy)phenyl]ethylimino]pyrrolidin-1-ium hydrochloride IUPAC Name: 1-[1-[3-(4-phenoxybutoxy)phenyl]ethylimino]pyrrolidin-1-ium hydrochloride Traditional Name: 1-[1-[3-(4-phenoxybutoxy)phenyl]ethylimino]pyrrolidin-1-ium hydrochloride Formula: C22H30ClN2O2+ MolecularWeight: 389.9388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OCCCCOC2=CC=CC=C2)N=[N+]3CCCC3.Cl

Isomeric SMILES

CC(C1=CC(=CC=C1)OCCCCOC2=CC=CC=C2)N=[N+]3CCCC3.Cl

InChI

InChI=1S/C22H29N2O2.ClH/c1-19(23-24-14-5-6-15-24)20-10-9-13-22(18-20)26-17-8-7-16-25-21-11-3-2-4-12-21;/h2-4,9-13,18-19H,5-8,14-17H2,1H3;1H/q+1;