[3-(2-azanylethyl)-2-propyl-phenyl]-(2-hydroxyethyl)-methyl-(phenylmethyl)azanium

Systemtic Name: [3-(2-azanylethyl)-2-propyl-phenyl]-(2-hydroxyethyl)-methyl-(phenylmethyl)azanium Openeye Name: [3-(2-aminoethyl)-2-propyl-phenyl]-benzyl-(2-hydroxyethyl)-methyl-ammonium CAS Name: [3-(2-aminoethyl)-2-propylphenyl]-(2-hydroxyethyl)-methyl-(phenylmethyl)ammonium IUPAC Name: [3-(2-aminoethyl)-2-propylphenyl]-benzyl-(2-hydroxyethyl)-methylazanium Traditional Name: [3-(2-aminoethyl)-2-propyl-phenyl]-benzyl-(2-hydroxyethyl)-methyl-ammonium Formula: C21H31N2O+ MolecularWeight: 327.48364

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1[N+](C)(CCO)CC2=CC=CC=C2)CCN

Isomeric SMILES

CCCC1=C(C=CC=C1[N+](C)(CCO)CC2=CC=CC=C2)CCN

InChI

InChI=1S/C21H31N2O/c1-3-8-20-19(13-14-22)11-7-12-21(20)23(2,15-16-24)17-18-9-5-4-6-10-18/h4-7,9-12,24H,3,8,13-17,22H2,1-2H3/q+1