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

Systemtic Name: furan-2-ylmethyl-[(5R)-1-(2-methylpropyl)-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: 2-furylmethyl-[(5R)-1-isobutyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: 2-furanylmethyl-[(5R)-1-(2-methylpropyl)-3-[oxo(1-pyrrolidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: furan-2-ylmethyl-[(5R)-1-(2-methylpropyl)-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: 2-furfuryl-[(5R)-1-isobutyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C21H31N4O2+ MolecularWeight: 371.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(CC(CC2)[NH2+]CC3=CC=CO3)C(=N1)C(=O)N4CCCC4

Isomeric SMILES

CC(C)CN1C2=C(C[C@@H](CC2)[NH2+]CC3=CC=CO3)C(=N1)C(=O)N4CCCC4

InChI

InChI=1S/C21H30N4O2/c1-15(2)14-25-19-8-7-16(22-13-17-6-5-11-27-17)12-18(19)20(23-25)21(26)24-9-3-4-10-24/h5-6,11,15-16,22H,3-4,7-10,12-14H2,1-2H3/p+1/t16-/m1/s1