3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl-methyl-[(2R)-2-phenylbutyl]azanium

Systemtic Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl-methyl-[(2R)-2-phenylbutyl]azanium Openeye Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl-methyl-[(2R)-2-phenylbutyl]ammonium CAS Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl-methyl-[(2R)-2-phenylbutyl]ammonium IUPAC Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl-methyl-[(2R)-2-phenylbutyl]azanium Traditional Name: 3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl-methyl-[(2R)-2-phenylbutyl]ammonium Formula: C19H30N3+ MolecularWeight: 300.4616

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C[NH+](C)CCCC1=C(NN=C1C)C)C2=CC=CC=C2

Isomeric SMILES

CC[C@@H](C[NH+](C)CCCC1=C(NN=C1C)C)C2=CC=CC=C2

InChI

InChI=1S/C19H29N3/c1-5-17(18-10-7-6-8-11-18)14-22(4)13-9-12-19-15(2)20-21-16(19)3/h6-8,10-11,17H,5,9,12-14H2,1-4H3,(H,20,21)/p+1/t17-/m0/s1