4-[(3-morpholin-4-ylquinoxalin-2-yl)oxymethyl]benzoic acid

Systemtic Name: 4-[(3-morpholin-4-ylquinoxalin-2-yl)oxymethyl]benzoic acid Openeye Name: 4-[(3-morpholinoquinoxalin-2-yl)oxymethyl]benzoic acid CAS Name: 4-[[3-(4-morpholinyl)-2-quinoxalinyl]oxymethyl]benzoic acid IUPAC Name: 4-[(3-morpholin-4-ylquinoxalin-2-yl)oxymethyl]benzoic acid Traditional Name: 4-[(3-morpholinoquinoxalin-2-yl)oxymethyl]benzoic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=CC=CC=C3N=C2OCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1COCCN1C2=NC3=CC=CC=C3N=C2OCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C20H19N3O4/c24-20(25)15-7-5-14(6-8-15)13-27-19-18(23-9-11-26-12-10-23)21-16-3-1-2-4-17(16)22-19/h1-8H,9-13H2,(H,24,25)