ethanedioic acid; N-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-propan-2-yloxy-propan-1-amine

Systemtic Name: ethanedioic acid; N-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-3-propan-2-yloxy-propan-1-amine Openeye Name: 3-isopropoxy-N-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]propan-1-amine; oxalic acid CAS Name: N-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-3-propan-2-yloxy-1-propanamine; oxalic acid IUPAC Name: N-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]-3-propan-2-yloxypropan-1-amine; oxalic acid Traditional Name: 3-isopropoxypropyl-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]amine; oxalic acid Formula: C25H31N3O6 MolecularWeight: 469.53014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNCC1=CN(N=C1C2=CC=C(C=C2)OC)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)OCCCNCC1=CN(N=C1C2=CC=C(C=C2)OC)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H29N3O2.C2H2O4/c1-18(2)28-15-7-14-24-16-20-17-26(21-8-5-4-6-9-21)25-23(20)19-10-12-22(27-3)13-11-19;3-1(4)2(5)6/h4-6,8-13,17-18,24H,7,14-16H2,1-3H3;(H,3,4)(H,5,6)