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

Systemtic Name: [(5R)-1-ethyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-bis(prop-2-enyl)azanium Openeye Name: diallyl-[(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: [(5R)-1-ethyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-bis(prop-2-enyl)ammonium IUPAC Name: [(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-bis(prop-2-enyl)azanium Traditional Name: diallyl-[(5R)-1-ethyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C21H33N4O+ MolecularWeight: 357.51292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN1C2=C(C[C@@H](CC2)[NH+](CC=C)CC=C)C(=N1)C(=O)N3CCCCC3

InChI

InChI=1S/C21H32N4O/c1-4-12-23(13-5-2)17-10-11-19-18(16-17)20(22-25(19)6-3)21(26)24-14-8-7-9-15-24/h4-5,17H,1-2,6-16H2,3H3/p+1/t17-/m1/s1