(4-bromophenyl)methyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[2-[(2-cyclopentyl-3-pyrazolyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: (4-bromobenzyl)-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C18H24BrN4O+ MolecularWeight: 392.31336

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)NC2=CC=NN2C3CCCC3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)NC2=CC=NN2C3CCCC3

InChI

InChI=1S/C18H23BrN4O/c1-22(12-14-6-8-15(19)9-7-14)13-18(24)21-17-10-11-20-23(17)16-4-2-3-5-16/h6-11,16H,2-5,12-13H2,1H3,(H,21,24)/p+1