(5-chloranyl-2-oxidanyl-phenyl)methyl-[(2R)-3-methyl-2-pyrrolidin-1-yl-butyl]azanium

Systemtic Name: (5-chloranyl-2-oxidanyl-phenyl)methyl-[(2R)-3-methyl-2-pyrrolidin-1-yl-butyl]azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-[(2R)-3-methyl-2-pyrrolidin-1-yl-butyl]ammonium CAS Name: (5-chloro-2-hydroxyphenyl)methyl-[(2R)-3-methyl-2-(1-pyrrolidinyl)butyl]ammonium IUPAC Name: (5-chloro-2-hydroxyphenyl)methyl-[(2R)-3-methyl-2-pyrrolidin-1-ylbutyl]azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-[(2R)-3-methyl-2-pyrrolidino-butyl]ammonium Formula: C16H26ClN2O+ MolecularWeight: 297.84344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C[NH2+]CC1=C(C=CC(=C1)Cl)O)N2CCCC2

Isomeric SMILES

CC(C)[C@H](C[NH2+]CC1=C(C=CC(=C1)Cl)O)N2CCCC2

InChI

InChI=1S/C16H25ClN2O/c1-12(2)15(19-7-3-4-8-19)11-18-10-13-9-14(17)5-6-16(13)20/h5-6,9,12,15,18,20H,3-4,7-8,10-11H2,1-2H3/p+1/t15-/m0/s1