ethanedioic acid; 3-(1-hexylpiperidin-4-yl)-1H-benzimidazol-2-one

Systemtic Name: ethanedioic acid; 3-(1-hexylpiperidin-4-yl)-1H-benzimidazol-2-one Openeye Name: 3-(1-hexyl-4-piperidyl)-1H-benzimidazol-2-one; oxalic acid CAS Name: 3-(1-hexyl-4-piperidinyl)-1H-benzimidazol-2-one; oxalic acid IUPAC Name: 3-(1-hexylpiperidin-4-yl)-1H-benzimidazol-2-one; oxalic acid Traditional Name: 3-(1-hexyl-4-piperidyl)-1H-benzimidazol-2-one; oxalic acid Formula: C20H29N3O5 MolecularWeight: 391.46136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCC(CC1)N2C3=CC=CC=C3NC2=O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCN1CCC(CC1)N2C3=CC=CC=C3NC2=O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H27N3O.C2H2O4/c1-2-3-4-7-12-20-13-10-15(11-14-20)21-17-9-6-5-8-16(17)19-18(21)22;3-1(4)2(5)6/h5-6,8-9,15H,2-4,7,10-14H2,1H3,(H,19,22);(H,3,4)(H,5,6)