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

Systemtic Name: ethyl-(2-methylprop-2-enyl)-[(5S)-3-piperidin-1-ylcarbonyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: [(5S)-1-allyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-ethyl-(2-methylallyl)ammonium CAS Name: ethyl-(2-methylprop-2-enyl)-[(5S)-3-[oxo(1-piperidinyl)methyl]-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: ethyl-(2-methylprop-2-enyl)-[(5S)-3-(piperidine-1-carbonyl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: [(5S)-1-allyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-ethyl-(2-methylallyl)ammonium Formula: C22H35N4O+ MolecularWeight: 371.5395

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=C)C)C1CCC2=C(C1)C(=NN2CC=C)C(=O)N3CCCCC3

Isomeric SMILES

CC[NH+](CC(=C)C)[C@H]1CCC2=C(C1)C(=NN2CC=C)C(=O)N3CCCCC3

InChI

InChI=1S/C22H34N4O/c1-5-12-26-20-11-10-18(24(6-2)16-17(3)4)15-19(20)21(23-26)22(27)25-13-8-7-9-14-25/h5,18H,1,3,6-16H2,2,4H3/p+1/t18-/m0/s1