[(5R)-3-piperidin-1-ylcarbonyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]-(2-pyridin-4-ylethyl)azanium

Systemtic Name: [(5R)-3-piperidin-1-ylcarbonyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]-(2-pyridin-4-ylethyl)azanium Openeye Name: [(5R)-1-allyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-[2-(4-pyridyl)ethyl]ammonium CAS Name: [(5R)-3-[oxo(1-piperidinyl)methyl]-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]-(2-pyridin-4-ylethyl)ammonium IUPAC Name: [(5R)-3-(piperidine-1-carbonyl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]-(2-pyridin-4-ylethyl)azanium Traditional Name: [(5R)-1-allyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-[2-(4-pyridyl)ethyl]ammonium Formula: C23H32N5O+ MolecularWeight: 394.53308

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(CC(CC2)[NH2+]CCC3=CC=NC=C3)C(=N1)C(=O)N4CCCCC4

Isomeric SMILES

C=CCN1C2=C(C[C@@H](CC2)[NH2+]CCC3=CC=NC=C3)C(=N1)C(=O)N4CCCCC4

InChI

InChI=1S/C23H31N5O/c1-2-14-28-21-7-6-19(25-13-10-18-8-11-24-12-9-18)17-20(21)22(26-28)23(29)27-15-4-3-5-16-27/h2,8-9,11-12,19,25H,1,3-7,10,13-17H2/p+1/t19-/m1/s1