(3S)-N-[2-[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide

Systemtic Name: (3S)-N-[2-[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide Openeye Name: (3S)-N-[2-[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]tetrahydrofuran-3-carboxamide CAS Name: (3S)-N-[2-[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-3-oxolanecarboxamide IUPAC Name: (3S)-N-[2-[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide Traditional Name: (3S)-N-[2-[1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]tetrahydrofuran-3-carboxamide Formula: C20H31N6O2+ MolecularWeight: 387.49914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4CCOC4

Isomeric SMILES

CCC1=NC(=C(N1)C)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)[C@H]4CCOC4

InChI

InChI=1S/C20H30N6O2/c1-3-18-22-14(2)17(23-18)12-25-9-5-16(6-10-25)26-19(4-8-21-26)24-20(27)15-7-11-28-13-15/h4,8,15-16H,3,5-7,9-13H2,1-2H3,(H,22,23)(H,24,27)/p+1/t15-/m0/s1