[(2R)-3-[4-(azocan-1-ium-1-ylmethyl)-2-methoxy-phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium

Systemtic Name: [(2R)-3-[4-(azocan-1-ium-1-ylmethyl)-2-methoxy-phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium Openeye Name: [(2R)-3-[4-(azocan-1-ium-1-ylmethyl)-2-methoxy-phenoxy]-2-hydroxy-propyl]-isopropyl-methyl-ammonium CAS Name: [(2R)-3-[4-(1-azocan-1-iumylmethyl)-2-methoxyphenoxy]-2-hydroxypropyl]-methyl-propan-2-ylammonium IUPAC Name: [(2R)-3-[4-(azocan-1-ium-1-ylmethyl)-2-methoxyphenoxy]-2-hydroxypropyl]-methyl-propan-2-ylazanium Traditional Name: [(2R)-3-[4-(azocan-1-ium-1-ylmethyl)-2-methoxy-phenoxy]-2-hydroxy-propyl]-isopropyl-methyl-ammonium Formula: C22H40N2O3+2 MolecularWeight: 380.5646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](C)CC(COC1=C(C=C(C=C1)C[NH+]2CCCCCCC2)OC)O

Isomeric SMILES

CC(C)[NH+](C)C[C@H](COC1=C(C=C(C=C1)C[NH+]2CCCCCCC2)OC)O

InChI

InChI=1S/C22H38N2O3/c1-18(2)23(3)16-20(25)17-27-21-11-10-19(14-22(21)26-4)15-24-12-8-6-5-7-9-13-24/h10-11,14,18,20,25H,5-9,12-13,15-17H2,1-4H3/p+2/t20-/m1/s1