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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C[NH3+])N(CC)CC2=CC=CC=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@H](C[NH3+])N(CC)CC2=CC=CC=C2

InChI

InChI=1S/C21H30N2O/c1-3-5-15-24-20-13-11-19(12-14-20)21(16-22)23(4-2)17-18-9-7-6-8-10-18/h6-14,21H,3-5,15-17,22H2,1-2H3/p+1/t21-/m0/s1