[(2R)-2-(3-ethoxy-4-oxidanyl-phenyl)-2-[(phenylmethyl)-propan-2-yl-amino]ethyl]azanium

Systemtic Name: [(2R)-2-(3-ethoxy-4-oxidanyl-phenyl)-2-[(phenylmethyl)-propan-2-yl-amino]ethyl]azanium Openeye Name: [(2R)-2-[benzyl(isopropyl)amino]-2-(3-ethoxy-4-hydroxy-phenyl)ethyl]ammonium CAS Name: [(2R)-2-(3-ethoxy-4-hydroxyphenyl)-2-[(phenylmethyl)-propan-2-ylamino]ethyl]ammonium IUPAC Name: [(2R)-2-[benzyl(propan-2-yl)amino]-2-(3-ethoxy-4-hydroxyphenyl)ethyl]azanium Traditional Name: [(2R)-2-[benzyl(isopropyl)amino]-2-(3-ethoxy-4-hydroxy-phenyl)ethyl]ammonium Formula: C20H29N2O2+ MolecularWeight: 329.45646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C[NH3+])N(CC2=CC=CC=C2)C(C)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@H](C[NH3+])N(CC2=CC=CC=C2)C(C)C)O

InChI

InChI=1S/C20H28N2O2/c1-4-24-20-12-17(10-11-19(20)23)18(13-21)22(15(2)3)14-16-8-6-5-7-9-16/h5-12,15,18,23H,4,13-14,21H2,1-3H3/p+1/t18-/m0/s1