1-(tert-butylamino)-3-[4-chloranyl-2-(1-pyrazol-1-ylethenyl)phenoxy]propan-2-ol; ethanedioic acid

Systemtic Name: 1-(tert-butylamino)-3-[4-chloranyl-2-(1-pyrazol-1-ylethenyl)phenoxy]propan-2-ol; ethanedioic acid Openeye Name: 1-(tert-butylamino)-3-[4-chloro-2-(1-pyrazol-1-ylvinyl)phenoxy]propan-2-ol; oxalic acid CAS Name: 1-(tert-butylamino)-3-[4-chloro-2-[1-(1-pyrazolyl)ethenyl]phenoxy]-2-propanol; oxalic acid IUPAC Name: 1-(tert-butylamino)-3-[4-chloro-2-(1-pyrazol-1-ylethenyl)phenoxy]propan-2-ol; oxalic acid Traditional Name: 1-(tert-butylamino)-3-[4-chloro-2-(1-pyrazol-1-ylvinyl)phenoxy]propan-2-ol; oxalic acid Formula: C20H26ClN3O6 MolecularWeight: 439.88994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=C(C=C1)Cl)C(=C)N2C=CC=N2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=C(C=C1)Cl)C(=C)N2C=CC=N2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H24ClN3O2.C2H2O4/c1-13(22-9-5-8-21-22)16-10-14(19)6-7-17(16)24-12-15(23)11-20-18(2,3)4;3-1(4)2(5)6/h5-10,15,20,23H,1,11-12H2,2-4H3;(H,3,4)(H,5,6)