ethanedioic acid; 1-(3-imidazol-1-ylpropylamino)-3-[(4-methoxyphenyl)methoxy]propan-2-ol

Systemtic Name: ethanedioic acid; 1-(3-imidazol-1-ylpropylamino)-3-[(4-methoxyphenyl)methoxy]propan-2-ol Openeye Name: 1-(3-imidazol-1-ylpropylamino)-3-[(4-methoxyphenyl)methoxy]propan-2-ol; oxalic acid CAS Name: 1-[3-(1-imidazolyl)propylamino]-3-[(4-methoxyphenyl)methoxy]-2-propanol; oxalic acid IUPAC Name: 1-(3-imidazol-1-ylpropylamino)-3-[(4-methoxyphenyl)methoxy]propan-2-ol; oxalic acid Traditional Name: 1-(3-imidazol-1-ylpropylamino)-3-p-anisyloxy-propan-2-ol; oxalic acid Formula: C19H27N3O7 MolecularWeight: 409.43358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COCC(CNCCCN2C=CN=C2)O.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)COCC(CNCCCN2C=CN=C2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H25N3O3.C2H2O4/c1-22-17-5-3-15(4-6-17)12-23-13-16(21)11-18-7-2-9-20-10-8-19-14-20;3-1(4)2(5)6/h3-6,8,10,14,16,18,21H,2,7,9,11-13H2,1H3;(H,3,4)(H,5,6)