furan-2-ylmethyl-methyl-[(5R)-1-(2-methylpropyl)-3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: furan-2-ylmethyl-methyl-[(5R)-1-(2-methylpropyl)-3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: 2-furylmethyl-[(5R)-1-isobutyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-methyl-ammonium CAS Name: 2-furanylmethyl-methyl-[(5R)-1-(2-methylpropyl)-3-[4-morpholinyl(oxo)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: furan-2-ylmethyl-methyl-[(5R)-1-(2-methylpropyl)-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: 2-furfuryl-[(5R)-1-isobutyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-methyl-ammonium Formula: C22H33N4O3+ MolecularWeight: 401.52242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(CC(CC2)[NH+](C)CC3=CC=CO3)C(=N1)C(=O)N4CCOCC4

Isomeric SMILES

CC(C)CN1C2=C(C[C@@H](CC2)[NH+](C)CC3=CC=CO3)C(=N1)C(=O)N4CCOCC4

InChI

InChI=1S/C22H32N4O3/c1-16(2)14-26-20-7-6-17(24(3)15-18-5-4-10-29-18)13-19(20)21(23-26)22(27)25-8-11-28-12-9-25/h4-5,10,16-17H,6-9,11-15H2,1-3H3/p+1/t17-/m1/s1