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

Systemtic Name: ethanedioic acid; 1-(3-imidazol-1-ylpropylamino)-3-naphthalen-1-yloxy-propan-2-ol Openeye Name: 1-(3-imidazol-1-ylpropylamino)-3-(1-naphthyloxy)propan-2-ol; oxalic acid CAS Name: 1-[3-(1-imidazolyl)propylamino]-3-(1-naphthalenyloxy)-2-propanol; oxalic acid IUPAC Name: 1-(3-imidazol-1-ylpropylamino)-3-naphthalen-1-yloxypropan-2-ol; oxalic acid Traditional Name: 1-(3-imidazol-1-ylpropylamino)-3-(1-naphthoxy)propan-2-ol; oxalic acid Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCC(CNCCCN3C=CN=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OCC(CNCCCN3C=CN=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23N3O2.C2H2O4/c23-17(13-20-9-4-11-22-12-10-21-15-22)14-24-19-8-3-6-16-5-1-2-7-18(16)19;3-1(4)2(5)6/h1-3,5-8,10,12,15,17,20,23H,4,9,11,13-14H2;(H,3,4)(H,5,6)