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

Systemtic Name: (3-chloranyl-4-oxidanyl-phenyl)methyl-[(1S)-1-(5-methyl-1-naphthalen-1-yl-pyrazol-4-yl)ethyl]azanium Openeye Name: (3-chloro-4-hydroxy-phenyl)methyl-[(1S)-1-[5-methyl-1-(1-naphthyl)pyrazol-4-yl]ethyl]ammonium CAS Name: (3-chloro-4-hydroxyphenyl)methyl-[(1S)-1-[5-methyl-1-(1-naphthalenyl)-4-pyrazolyl]ethyl]ammonium IUPAC Name: (3-chloro-4-hydroxyphenyl)methyl-[(1S)-1-(5-methyl-1-naphthalen-1-ylpyrazol-4-yl)ethyl]azanium Traditional Name: (3-chloro-4-hydroxy-benzyl)-[(1S)-1-[5-methyl-1-(1-naphthyl)pyrazol-4-yl]ethyl]ammonium Formula: C23H23ClN3O+ MolecularWeight: 392.90122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC3=CC=CC=C32)C(C)[NH2+]CC4=CC(=C(C=C4)O)Cl

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC3=CC=CC=C32)[C@H](C)[NH2+]CC4=CC(=C(C=C4)O)Cl

InChI

InChI=1S/C23H22ClN3O/c1-15(25-13-17-10-11-23(28)21(24)12-17)20-14-26-27(16(20)2)22-9-5-7-18-6-3-4-8-19(18)22/h3-12,14-15,25,28H,13H2,1-2H3/p+1/t15-/m0/s1