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

Systemtic Name: N-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-3-phenoxy-propanamide Openeye Name: N-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-3-phenoxy-propanamide CAS Name: N-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-3-phenoxypropanamide IUPAC Name: N-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-3-phenoxypropanamide Traditional Name: N-[2-[1-[(5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-3-phenoxy-propionamide Formula: C22H29N6O2+ MolecularWeight: 409.50466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=CN1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CCOC4=CC=CC=C4

InChI

InChI=1S/C22H28N6O2/c1-17-20(24-16-23-17)15-27-12-8-18(9-13-27)28-21(7-11-25-28)26-22(29)10-14-30-19-5-3-2-4-6-19/h2-7,11,16,18H,8-10,12-15H2,1H3,(H,23,24)(H,26,29)/p+1