[(5R)-1-ethyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(3-propan-2-yloxypropyl)azanium

Systemtic Name: [(5R)-1-ethyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(3-propan-2-yloxypropyl)azanium Openeye Name: [(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(3-isopropoxypropyl)ammonium CAS Name: [(5R)-1-ethyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(3-propan-2-yloxypropyl)azanium Traditional Name: [(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-(3-isopropoxypropyl)ammonium Formula: C21H37N4O2+ MolecularWeight: 377.54408

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)[NH2+]CCCOC(C)C)C(=N1)C(=O)N3CCCCC3

Isomeric SMILES

CCN1C2=C(C[C@@H](CC2)[NH2+]CCCOC(C)C)C(=N1)C(=O)N3CCCCC3

InChI

InChI=1S/C21H36N4O2/c1-4-25-19-10-9-17(22-11-8-14-27-16(2)3)15-18(19)20(23-25)21(26)24-12-6-5-7-13-24/h16-17,22H,4-15H2,1-3H3/p+1/t17-/m1/s1