[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: [5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl-[(1R)-1-phenylethyl]azanium Openeye Name: [5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl-[(1R)-1-phenylethyl]ammonium CAS Name: [5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: [5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl-[(1R)-1-phenylethyl]azanium Traditional Name: [5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl-[(1R)-1-phenylethyl]ammonium Formula: C18H18Cl2N3+ MolecularWeight: 347.26162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC2=C(NN=C2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC2=C(NN=C2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H17Cl2N3/c1-12(13-5-3-2-4-6-13)21-10-14-11-22-23-18(14)16-8-7-15(19)9-17(16)20/h2-9,11-12,21H,10H2,1H3,(H,22,23)/p+1/t12-/m1/s1