3-methyl-N-[2-[1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide

Systemtic Name: 3-methyl-N-[2-[1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Openeye Name: 3-methyl-N-[2-[1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide CAS Name: 3-methyl-N-[2-[1-[(2-methyl-1H-imidazol-5-yl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]butanamide IUPAC Name: 3-methyl-N-[2-[1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Traditional Name: 3-methyl-N-[2-[1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]butyramide Formula: C18H29N6O+ MolecularWeight: 345.46246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CC(C)C

Isomeric SMILES

CC1=NC=C(N1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CC(C)C

InChI

InChI=1S/C18H28N6O/c1-13(2)10-18(25)22-17-4-7-20-24(17)16-5-8-23(9-6-16)12-15-11-19-14(3)21-15/h4,7,11,13,16H,5-6,8-10,12H2,1-3H3,(H,19,21)(H,22,25)/p+1