methyl-[(4-pyrazol-1-ylphenyl)methyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium

Systemtic Name: methyl-[(4-pyrazol-1-ylphenyl)methyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium Openeye Name: methyl-[(4-pyrazol-1-ylphenyl)methyl]-[(1S)-tetralin-1-yl]ammonium CAS Name: methyl-[[4-(1-pyrazolyl)phenyl]methyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]ammonium IUPAC Name: methyl-[(4-pyrazol-1-ylphenyl)methyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium Traditional Name: methyl-(4-pyrazol-1-ylbenzyl)-[(1S)-tetralin-1-yl]ammonium Formula: C21H24N3+ MolecularWeight: 318.43536

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)N2C=CC=N2)C3CCCC4=CC=CC=C34

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)N2C=CC=N2)[C@H]3CCCC4=CC=CC=C34

InChI

InChI=1S/C21H23N3/c1-23(21-9-4-7-18-6-2-3-8-20(18)21)16-17-10-12-19(13-11-17)24-15-5-14-22-24/h2-3,5-6,8,10-15,21H,4,7,9,16H2,1H3/p+1/t21-/m0/s1