[(2R)-2-[methyl-(phenylmethyl)amino]-2-(4-pentoxyphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[methyl-(phenylmethyl)amino]-2-(4-pentoxyphenyl)ethyl]azanium Openeye Name: [(2R)-2-[benzyl(methyl)amino]-2-(4-pentoxyphenyl)ethyl]ammonium CAS Name: [(2R)-2-[methyl-(phenylmethyl)amino]-2-(4-pentoxyphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[benzyl(methyl)amino]-2-(4-pentoxyphenyl)ethyl]azanium Traditional Name: [(2R)-2-(4-amoxyphenyl)-2-[benzyl(methyl)amino]ethyl]ammonium Formula: C21H31N2O+ MolecularWeight: 327.48364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(C[NH3+])N(C)CC2=CC=CC=C2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)[C@H](C[NH3+])N(C)CC2=CC=CC=C2

InChI

InChI=1S/C21H30N2O/c1-3-4-8-15-24-20-13-11-19(12-14-20)21(16-22)23(2)17-18-9-6-5-7-10-18/h5-7,9-14,21H,3-4,8,15-17,22H2,1-2H3/p+1/t21-/m0/s1