(1-phenylpyrazol-4-yl)methyl-prop-2-enyl-azanium

Systemtic Name: (1-phenylpyrazol-4-yl)methyl-prop-2-enyl-azanium Openeye Name: allyl-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: (1-phenyl-4-pyrazolyl)methyl-prop-2-enylammonium IUPAC Name: (1-phenylpyrazol-4-yl)methyl-prop-2-enylazanium Traditional Name: allyl-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C13H16N3+ MolecularWeight: 214.28624

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH2+]CC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

C=CC[NH2+]CC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C13H15N3/c1-2-8-14-9-12-10-15-16(11-12)13-6-4-3-5-7-13/h2-7,10-11,14H,1,8-9H2/p+1