N-methyl-2-[(2R)-1-[(5-methylfuran-2-yl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[(3-methylpyridin-4-yl)methyl]ethanamide

Systemtic Name: N-methyl-2-[(2R)-1-[(5-methylfuran-2-yl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[(3-methylpyridin-4-yl)methyl]ethanamide Openeye Name: N-methyl-2-[(2R)-1-[(5-methyl-2-furyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-[(3-methyl-4-pyridyl)methyl]acetamide CAS Name: N-methyl-2-[(2R)-1-[(5-methyl-2-furanyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-[(3-methyl-4-pyridinyl)methyl]acetamide IUPAC Name: N-methyl-2-[(2R)-1-[(5-methylfuran-2-yl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-[(3-methylpyridin-4-yl)methyl]acetamide Traditional Name: 2-[(2R)-3-keto-1-[(5-methyl-2-furyl)methyl]piperazin-1-ium-2-yl]-N-methyl-N-[(3-methyl-4-pyridyl)methyl]acetamide Formula: C20H27N4O3+ MolecularWeight: 371.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCNC(=O)C2CC(=O)N(C)CC3=C(C=NC=C3)C

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCNC(=O)[C@H]2CC(=O)N(C)CC3=C(C=NC=C3)C

InChI

InChI=1S/C20H26N4O3/c1-14-11-21-7-6-16(14)12-23(3)19(25)10-18-20(26)22-8-9-24(18)13-17-5-4-15(2)27-17/h4-7,11,18H,8-10,12-13H2,1-3H3,(H,22,26)/p+1/t18-/m1/s1