1,3,5-trimethyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyrazol-4-amine

Systemtic Name: 1,3,5-trimethyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyrazol-4-amine Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1,3,5-trimethyl-pyrazol-4-amine CAS Name: 1,3,5-trimethyl-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-4-pyrazolamine IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1,3,5-trimethylpyrazol-4-amine Traditional Name: [(3S)-1-benzylpyrrolidin-1-ium-3-yl]-(1,3,5-trimethylpyrazol-4-yl)amine Formula: C17H25N4+ MolecularWeight: 285.4072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC2CC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C)C)N[C@H]2CC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H24N4/c1-13-17(14(2)20(3)19-13)18-16-9-10-21(12-16)11-15-7-5-4-6-8-15/h4-8,16,18H,9-12H2,1-3H3/p+1/t16-/m0/s1