(3-chloranyl-4-oxidanyl-phenyl)methyl-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]azanium

Systemtic Name: (3-chloranyl-4-oxidanyl-phenyl)methyl-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]azanium Openeye Name: (3-chloro-4-hydroxy-phenyl)methyl-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]ammonium CAS Name: (3-chloro-4-hydroxyphenyl)methyl-[(1S)-1-(5-methyl-1-phenyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: (3-chloro-4-hydroxyphenyl)methyl-[(1S)-1-(5-methyl-1-phenylpyrazol-4-yl)ethyl]azanium Traditional Name: (3-chloro-4-hydroxy-benzyl)-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]ammonium Formula: C19H21ClN3O+ MolecularWeight: 342.84254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(C)[NH2+]CC3=CC(=C(C=C3)O)Cl

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)[C@H](C)[NH2+]CC3=CC(=C(C=C3)O)Cl

InChI

InChI=1S/C19H20ClN3O/c1-13(21-11-15-8-9-19(24)18(20)10-15)17-12-22-23(14(17)2)16-6-4-3-5-7-16/h3-10,12-13,21,24H,11H2,1-2H3/p+1/t13-/m0/s1