[(2R)-2-[4-[(2-methylphenyl)methoxy]phenyl]-2-pyrrolidin-1-ium-1-yl-ethyl]azanium

Systemtic Name: [(2R)-2-[4-[(2-methylphenyl)methoxy]phenyl]-2-pyrrolidin-1-ium-1-yl-ethyl]azanium Openeye Name: [(2R)-2-[4-(o-tolylmethoxy)phenyl]-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium CAS Name: [(2R)-2-[4-[(2-methylphenyl)methoxy]phenyl]-2-(1-pyrrolidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-[4-[(2-methylphenyl)methoxy]phenyl]-2-pyrrolidin-1-ium-1-ylethyl]azanium Traditional Name: [(2R)-2-[4-(2-methylbenzyl)oxyphenyl]-2-pyrrolidin-1-ium-1-yl-ethyl]ammonium Formula: C20H28N2O+2 MolecularWeight: 312.44912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC2=CC=C(C=C2)C(C[NH3+])[NH+]3CCCC3

Isomeric SMILES

CC1=CC=CC=C1COC2=CC=C(C=C2)[C@H](C[NH3+])[NH+]3CCCC3

InChI

InChI=1S/C20H26N2O/c1-16-6-2-3-7-18(16)15-23-19-10-8-17(9-11-19)20(14-21)22-12-4-5-13-22/h2-3,6-11,20H,4-5,12-15,21H2,1H3/p+2/t20-/m0/s1