(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl-[(1R)-1-phenylethyl]azanium Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl-[(1R)-1-phenylethyl]ammonium CAS Name: (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl-[(1R)-1-phenylethyl]azanium Traditional Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl-[(1R)-1-phenylethyl]ammonium Formula: C19H21ClN3+ MolecularWeight: 326.84314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH2+]C(C)C2=CC=CC=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C[NH2+][C@H](C)C2=CC=CC=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3/c1-14(16-9-5-3-6-10-16)21-13-18-15(2)22-23(19(18)20)17-11-7-4-8-12-17/h3-12,14,21H,13H2,1-2H3/p+1/t14-/m1/s1