3-[[(3R)-3-(2-methoxyphenyl)-4-methyl-pentanoyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(3R)-3-(2-methoxyphenyl)-4-methyl-pentanoyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(3R)-3-(2-methoxyphenyl)-4-methyl-pentanoyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(3R)-3-(2-methoxyphenyl)-4-methyl-1-oxopentyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(3R)-3-(2-methoxyphenyl)-4-methylpentanoyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(3R)-3-(2-methoxyphenyl)-4-methyl-pentanoyl]amino]propyl-dimethyl-ammonium Formula: C18H31N2O2+ MolecularWeight: 307.45094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)NCCC[NH+](C)C)C1=CC=CC=C1OC

Isomeric SMILES

CC(C)[C@@H](CC(=O)NCCC[NH+](C)C)C1=CC=CC=C1OC

InChI

InChI=1S/C18H30N2O2/c1-14(2)16(15-9-6-7-10-17(15)22-5)13-18(21)19-11-8-12-20(3)4/h6-7,9-10,14,16H,8,11-13H2,1-5H3,(H,19,21)/p+1/t16-/m1/s1