[(5R)-1-methyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(5R)-1-methyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(5R)-1-methyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [(5R)-1-methyl-5-(1-piperidin-1-iumyl)-4,5,6,7-tetrahydroindazol-3-yl]-(1-pyrrolidinyl)methanone IUPAC Name: [(5R)-1-methyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(5R)-1-methyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidino-methanone Formula: C18H29N4O+ MolecularWeight: 317.44906

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH+]3CCCCC3)C(=N1)C(=O)N4CCCC4

Isomeric SMILES

CN1C2=C(C[C@@H](CC2)[NH+]3CCCCC3)C(=N1)C(=O)N4CCCC4

InChI

InChI=1S/C18H28N4O/c1-20-16-8-7-14(21-9-3-2-4-10-21)13-15(16)17(19-20)18(23)22-11-5-6-12-22/h14H,2-13H2,1H3/p+1/t14-/m1/s1