2,5-dimethyl-3-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]pyrazine

Systemtic Name: 2,5-dimethyl-3-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]pyrazine Openeye Name: 2,5-dimethyl-3-[(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]pyrazine CAS Name: 2,5-dimethyl-3-[(3R)-3-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-1-pyrrolidinyl]pyrazine IUPAC Name: 2,5-dimethyl-3-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]pyrazine Traditional Name: 2,5-dimethyl-3-[(3R)-3-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]pyrrolidino]pyrazine Formula: C21H30N5+ MolecularWeight: 352.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)N2CCC(C2)C3CC[NH+](CC3)CC4=CN=CC=C4)C

Isomeric SMILES

CC1=CN=C(C(=N1)N2CC[C@@H](C2)C3CC[NH+](CC3)CC4=CN=CC=C4)C

InChI

InChI=1S/C21H29N5/c1-16-12-23-17(2)21(24-16)26-11-7-20(15-26)19-5-9-25(10-6-19)14-18-4-3-8-22-13-18/h3-4,8,12-13,19-20H,5-7,9-11,14-15H2,1-2H3/p+1/t20-/m0/s1