N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-7-chloranyl-4-oxidanylidene-1H-quinoline-2-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-7-chloranyl-4-oxidanylidene-1H-quinoline-2-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]-7-chloro-4-oxo-1H-quinoline-2-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]-7-chloro-4-oxo-1H-quinoline-2-carboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-7-chloro-4-oxo-1H-quinoline-2-carboxamide Traditional Name: 7-chloro-4-keto-N-(1-piperonyl-4-piperidyl)-1H-quinoline-2-carboxamide Formula: C23H22ClN3O4 MolecularWeight: 439.89148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC(=O)C3=C(N2)C=C(C=C3)Cl)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC(=O)C3=C(N2)C=C(C=C3)Cl)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H22ClN3O4/c24-15-2-3-17-18(10-15)26-19(11-20(17)28)23(29)25-16-5-7-27(8-6-16)12-14-1-4-21-22(9-14)31-13-30-21/h1-4,9-11,16H,5-8,12-13H2,(H,25,29)(H,26,28)