[(2R)-3-[4-[(2-diethylaminoethylazaniumyl)methyl]-2-methoxy-phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium

Systemtic Name: [(2R)-3-[4-[(2-diethylaminoethylazaniumyl)methyl]-2-methoxy-phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium Openeye Name: [(2R)-3-[4-[(2-diethylaminoethylammonio)methyl]-2-methoxy-phenoxy]-2-hydroxy-propyl]-isopropyl-methyl-ammonium CAS Name: [(2R)-3-[4-[(2-diethylaminoethylammonio)methyl]-2-methoxyphenoxy]-2-hydroxypropyl]-methyl-propan-2-ylammonium IUPAC Name: [(2R)-3-[4-[(2-diethylaminoethylazaniumyl)methyl]-2-methoxyphenoxy]-2-hydroxypropyl]-methyl-propan-2-ylazanium Traditional Name: [(2R)-3-[4-[(2-diethylaminoethylammonio)methyl]-2-methoxy-phenoxy]-2-hydroxy-propyl]-isopropyl-methyl-ammonium Formula: C21H41N3O3+2 MolecularWeight: 383.56854

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[NH2+]CC1=CC(=C(C=C1)OCC(C[NH+](C)C(C)C)O)OC

Isomeric SMILES

CCN(CC)CC[NH2+]CC1=CC(=C(C=C1)OC[C@@H](C[NH+](C)C(C)C)O)OC

InChI

InChI=1S/C21H39N3O3/c1-7-24(8-2)12-11-22-14-18-9-10-20(21(13-18)26-6)27-16-19(25)15-23(5)17(3)4/h9-10,13,17,19,22,25H,7-8,11-12,14-16H2,1-6H3/p+2/t19-/m1/s1