butyl-[(5S)-1-(2-methylpropyl)-3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: butyl-[(5S)-1-(2-methylpropyl)-3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: butyl-[(5S)-1-isobutyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: butyl-[(5S)-1-(2-methylpropyl)-3-[4-morpholinyl(oxo)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: butyl-[(5S)-1-(2-methylpropyl)-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: butyl-[(5S)-1-isobutyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C20H35N4O2+ MolecularWeight: 363.5175

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]C1CCC2=C(C1)C(=NN2CC(C)C)C(=O)N3CCOCC3

Isomeric SMILES

CCCC[NH2+][C@H]1CCC2=C(C1)C(=NN2CC(C)C)C(=O)N3CCOCC3

InChI

InChI=1S/C20H34N4O2/c1-4-5-8-21-16-6-7-18-17(13-16)19(22-24(18)14-15(2)3)20(25)23-9-11-26-12-10-23/h15-16,21H,4-14H2,1-3H3/p+1/t16-/m0/s1