2-hydroxyethyl-[(5R)-1-methyl-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(phenylmethyl)azanium

Systemtic Name: 2-hydroxyethyl-[(5R)-1-methyl-3-pyrrolidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]-(phenylmethyl)azanium Openeye Name: benzyl-(2-hydroxyethyl)-[(5R)-1-methyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: 2-hydroxyethyl-[(5R)-1-methyl-3-[oxo(1-pyrrolidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-(2-hydroxyethyl)-[(5R)-1-methyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: benzyl-(2-hydroxyethyl)-[(5R)-1-methyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH+](CCO)CC3=CC=CC=C3)C(=N1)C(=O)N4CCCC4

Isomeric SMILES

CN1C2=C(C[C@@H](CC2)[NH+](CCO)CC3=CC=CC=C3)C(=N1)C(=O)N4CCCC4

InChI

InChI=1S/C22H30N4O2/c1-24-20-10-9-18(26(13-14-27)16-17-7-3-2-4-8-17)15-19(20)21(23-24)22(28)25-11-5-6-12-25/h2-4,7-8,18,27H,5-6,9-16H2,1H3/p+1/t18-/m1/s1