ethanedioic acid; 1-[4-(imidazol-1-ylmethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol

Systemtic Name: ethanedioic acid; 1-[4-(imidazol-1-ylmethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol Openeye Name: 1-[4-(imidazol-1-ylmethyl)phenoxy]-3-(isopropylamino)propan-2-ol; oxalic acid CAS Name: 1-[4-(1-imidazolylmethyl)phenoxy]-3-(propan-2-ylamino)-2-propanol; oxalic acid IUPAC Name: 1-[4-(imidazol-1-ylmethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol; oxalic acid Traditional Name: 1-[4-(imidazol-1-ylmethyl)phenoxy]-3-(isopropylamino)propan-2-ol; oxalic acid Formula: C20H27N3O10 MolecularWeight: 469.44248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=C(C=C1)CN2C=CN=C2)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)NCC(COC1=CC=C(C=C1)CN2C=CN=C2)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23N3O2.2C2H2O4/c1-13(2)18-9-15(20)11-21-16-5-3-14(4-6-16)10-19-8-7-17-12-19;2*3-1(4)2(5)6/h3-8,12-13,15,18,20H,9-11H2,1-2H3;2*(H,3,4)(H,5,6)