4-[[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methylamino]cyclohexan-1-ol; ethanedioic acid

Systemtic Name: 4-[[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methylamino]cyclohexan-1-ol; ethanedioic acid Openeye Name: 4-[[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]methylamino]cyclohexanol; oxalic acid CAS Name: 4-[[2,5-dimethyl-1-(2-propan-2-yl-3-pyrazolyl)-3-pyrrolyl]methylamino]-1-cyclohexanol; oxalic acid IUPAC Name: 4-[[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]methylamino]cyclohexan-1-ol; oxalic acid Traditional Name: 4-[[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]methylamino]cyclohexanol; oxalic acid Formula: C21H32N4O5 MolecularWeight: 420.50258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)CNC3CCC(CC3)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)CNC3CCC(CC3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H30N4O.C2H2O4/c1-13(2)23-19(9-10-21-23)22-14(3)11-16(15(22)4)12-20-17-5-7-18(24)8-6-17;3-1(4)2(5)6/h9-11,13,17-18,20,24H,5-8,12H2,1-4H3;(H,3,4)(H,5,6)