N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[1-oxo-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]benzamide Traditional Name: 2-[3-(2-keto-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]-N-piperonyl-benzamide Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC2=CC=CC=C21)CCC(=O)NC3=CC=CC=C3C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C(C(=O)NC2=CC=CC=C21)CCC(=O)NC3=CC=CC=C3C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H25N3O5/c31-25(12-10-19-14-18-5-1-3-7-21(18)30-26(19)32)29-22-8-4-2-6-20(22)27(33)28-15-17-9-11-23-24(13-17)35-16-34-23/h1-9,11,13,19H,10,12,14-16H2,(H,28,33)(H,29,31)(H,30,32)