ethanedioic acid; 1-(3-imidazol-1-ylpropylamino)-3-(2-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: ethanedioic acid; 1-(3-imidazol-1-ylpropylamino)-3-(2-propan-2-ylphenoxy)propan-2-ol Openeye Name: 1-(3-imidazol-1-ylpropylamino)-3-(2-isopropylphenoxy)propan-2-ol; oxalic acid CAS Name: 1-[3-(1-imidazolyl)propylamino]-3-(2-propan-2-ylphenoxy)-2-propanol; oxalic acid IUPAC Name: 1-(3-imidazol-1-ylpropylamino)-3-(2-propan-2-ylphenoxy)propan-2-ol; oxalic acid Traditional Name: 1-(3-imidazol-1-ylpropylamino)-3-(2-isopropylphenoxy)propan-2-ol; oxalic acid Formula: C20H29N3O6 MolecularWeight: 407.46076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(CNCCCN2C=CN=C2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC(CNCCCN2C=CN=C2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H27N3O2.C2H2O4/c1-15(2)17-6-3-4-7-18(17)23-13-16(22)12-19-8-5-10-21-11-9-20-14-21;3-1(4)2(5)6/h3-4,6-7,9,11,14-16,19,22H,5,8,10,12-13H2,1-2H3;(H,3,4)(H,5,6)