N-[2-[(1R)-1-cyclopropylethyl]-1H-pyrazol-2-ium-3-yl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide

Systemtic Name: N-[2-[(1R)-1-cyclopropylethyl]-1H-pyrazol-2-ium-3-yl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide Openeye Name: N-[2-[(1R)-1-cyclopropylethyl]-1H-pyrazol-2-ium-3-yl]-2-pyrrolidin-1-yl-pyridine-3-carboxamide CAS Name: N-[2-[(1R)-1-cyclopropylethyl]-1H-pyrazol-2-ium-3-yl]-2-(1-pyrrolidinyl)-3-pyridinecarboxamide IUPAC Name: N-[2-[(1R)-1-cyclopropylethyl]-1H-pyrazol-2-ium-3-yl]-2-pyrrolidin-1-ylpyridine-3-carboxamide Traditional Name: N-[2-[(1R)-1-cyclopropylethyl]-1H-pyrazol-2-ium-3-yl]-2-pyrrolidino-nicotinamide Formula: C18H24N5O+ MolecularWeight: 326.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)[N+]2=C(C=CN2)NC(=O)C3=C(N=CC=C3)N4CCCC4

Isomeric SMILES

C[C@H](C1CC1)[N+]2=C(C=CN2)NC(=O)C3=C(N=CC=C3)N4CCCC4

InChI

InChI=1S/C18H23N5O/c1-13(14-6-7-14)23-16(8-10-20-23)21-18(24)15-5-4-9-19-17(15)22-11-2-3-12-22/h4-5,8-10,13-14H,2-3,6-7,11-12H2,1H3,(H,20,21,24)/p+1/t13-/m1/s1