N3-(1,3-benzodioxol-5-ylmethyl)-4-oxidanylidene-1-(phenylmethyl)-N5-prop-2-enyl-pyridine-3,5-dicarboxamide

Systemtic Name: N3-(1,3-benzodioxol-5-ylmethyl)-4-oxidanylidene-1-(phenylmethyl)-N5-prop-2-enyl-pyridine-3,5-dicarboxamide Openeye Name: N5-allyl-N3-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-4-oxo-pyridine-3,5-dicarboxamide CAS Name: N3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-1-(phenylmethyl)-N5-prop-2-enylpyridine-3,5-dicarboxamide IUPAC Name: 3-N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-4-oxo-5-N-prop-2-enylpyridine-3,5-dicarboxamide Traditional Name: N'-allyl-1-benzyl-4-keto-N-piperonyl-dinicotinamide Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CN(C=C(C1=O)C(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4

Isomeric SMILES

C=CCNC(=O)C1=CN(C=C(C1=O)C(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4

InChI

InChI=1S/C25H23N3O5/c1-2-10-26-24(30)19-14-28(13-17-6-4-3-5-7-17)15-20(23(19)29)25(31)27-12-18-8-9-21-22(11-18)33-16-32-21/h2-9,11,14-15H,1,10,12-13,16H2,(H,26,30)(H,27,31)