3-cyclopentylpropyl-[[4-methoxy-3-[(2R)-3-(4-methyl-1,4-diazepan-1-ium-1-yl)-2-oxidanyl-propoxy]phenyl]methyl]-methyl-azanium

Systemtic Name: 3-cyclopentylpropyl-[[4-methoxy-3-[(2R)-3-(4-methyl-1,4-diazepan-1-ium-1-yl)-2-oxidanyl-propoxy]phenyl]methyl]-methyl-azanium Openeye Name: 3-cyclopentylpropyl-[[3-[(2R)-2-hydroxy-3-(4-methyl-1,4-diazepan-1-ium-1-yl)propoxy]-4-methoxy-phenyl]methyl]-methyl-ammonium CAS Name: 3-cyclopentylpropyl-[[3-[(2R)-2-hydroxy-3-(4-methyl-1,4-diazepan-1-ium-1-yl)propoxy]-4-methoxyphenyl]methyl]-methylammonium IUPAC Name: 3-cyclopentylpropyl-[[3-[(2R)-2-hydroxy-3-(4-methyl-1,4-diazepan-1-ium-1-yl)propoxy]-4-methoxyphenyl]methyl]-methylazanium Traditional Name: 3-cyclopentylpropyl-[3-[(2R)-2-hydroxy-3-(4-methyl-1,4-diazepan-1-ium-1-yl)propoxy]-4-methoxy-benzyl]-methyl-ammonium Formula: C26H47N3O3+2 MolecularWeight: 449.66968

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC[NH+](CC1)CC(COC2=C(C=CC(=C2)C[NH+](C)CCCC3CCCC3)OC)O

Isomeric SMILES

CN1CCC[NH+](CC1)C[C@H](COC2=C(C=CC(=C2)C[NH+](C)CCCC3CCCC3)OC)O

InChI

InChI=1S/C26H45N3O3/c1-27-14-7-15-29(17-16-27)20-24(30)21-32-26-18-23(11-12-25(26)31-3)19-28(2)13-6-10-22-8-4-5-9-22/h11-12,18,22,24,30H,4-10,13-17,19-21H2,1-3H3/p+2/t24-/m1/s1