1-[8-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethoxy]quinolin-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[8-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethoxy]quinolin-2-yl]piperidine-4-carboxamide Openeye Name: 1-[8-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethoxy]-2-quinolyl]piperidine-4-carboxamide CAS Name: 1-[8-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethoxy]-2-quinolinyl]-4-piperidinecarboxamide IUPAC Name: 1-[8-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethoxy]quinolin-2-yl]piperidine-4-carboxamide Traditional Name: 1-[8-[2-keto-2-(piperonylamino)ethoxy]-2-quinolyl]isonipecotamide Formula: C25H26N4O5 MolecularWeight: 462.49774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C2=NC3=C(C=CC=C3OCC(=O)NCC4=CC5=C(C=C4)OCO5)C=C2

Isomeric SMILES

C1CN(CCC1C(=O)N)C2=NC3=C(C=CC=C3OCC(=O)NCC4=CC5=C(C=C4)OCO5)C=C2

InChI

InChI=1S/C25H26N4O5/c26-25(31)18-8-10-29(11-9-18)22-7-5-17-2-1-3-20(24(17)28-22)32-14-23(30)27-13-16-4-6-19-21(12-16)34-15-33-19/h1-7,12,18H,8-11,13-15H2,(H2,26,31)(H,27,30)