dimethyl-[3-[[(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentanoyl]amino]propyl]azanium

Systemtic Name: dimethyl-[3-[[(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentanoyl]amino]propyl]azanium Openeye Name: 3-[[(3S)-3-(4-isopropoxyphenyl)-4-methyl-pentanoyl]amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[(3S)-4-methyl-1-oxo-3-(4-propan-2-yloxyphenyl)pentyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[(3S)-4-methyl-3-(4-propan-2-yloxyphenyl)pentanoyl]amino]propyl]azanium Traditional Name: 3-[[(3S)-3-(4-isopropoxyphenyl)-4-methyl-pentanoyl]amino]propyl-dimethyl-ammonium Formula: C20H35N2O2+ MolecularWeight: 335.5041

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)NCCC[NH+](C)C)C1=CC=C(C=C1)OC(C)C

Isomeric SMILES

CC(C)[C@H](CC(=O)NCCC[NH+](C)C)C1=CC=C(C=C1)OC(C)C

InChI

InChI=1S/C20H34N2O2/c1-15(2)19(14-20(23)21-12-7-13-22(5)6)17-8-10-18(11-9-17)24-16(3)4/h8-11,15-16,19H,7,12-14H2,1-6H3,(H,21,23)/p+1/t19-/m0/s1