ethanedioic acid; N-[4-(1-imidazol-1-yloctan-2-yloxy)phenyl]ethanamide

Systemtic Name: ethanedioic acid; N-[4-(1-imidazol-1-yloctan-2-yloxy)phenyl]ethanamide Openeye Name: N-[4-[1-(imidazol-1-ylmethyl)heptoxy]phenyl]acetamide; oxalic acid CAS Name: N-[4-[1-(1-imidazolyl)octan-2-yloxy]phenyl]acetamide; oxalic acid IUPAC Name: N-[4-(1-imidazol-1-yloctan-2-yloxy)phenyl]acetamide; oxalic acid Traditional Name: N-[4-[1-(imidazol-1-ylmethyl)heptoxy]phenyl]acetamide; oxalic acid Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CN1C=CN=C1)OC2=CC=C(C=C2)NC(=O)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCC(CN1C=CN=C1)OC2=CC=C(C=C2)NC(=O)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H27N3O2.C2H2O4/c1-3-4-5-6-7-19(14-22-13-12-20-15-22)24-18-10-8-17(9-11-18)21-16(2)23;3-1(4)2(5)6/h8-13,15,19H,3-7,14H2,1-2H3,(H,21,23);(H,3,4)(H,5,6)