N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxo-ethyl]-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxoethyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[2-[2-(1,3-benzodioxol-5-yl)ethylamino]-2-oxoethyl]-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-[2-(homopiperonylamino)-2-keto-ethyl]-4-keto-1H-quinoline-3-carboxamide Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)CNC(=O)C3=CNC4=CC=CC=C4C3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)CNC(=O)C3=CNC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N3O5/c25-19(22-8-7-13-5-6-17-18(9-13)29-12-28-17)11-24-21(27)15-10-23-16-4-2-1-3-14(16)20(15)26/h1-6,9-10H,7-8,11-12H2,(H,22,25)(H,23,26)(H,24,27)