N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxidanylidene-ethyl]-4-butoxy-benzamide

Systemtic Name: N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxidanylidene-ethyl]-4-butoxy-benzamide Openeye Name: N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylene)hydrazino]-2-oxo-ethyl]-4-butoxy-benzamide CAS Name: N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxoethyl]-4-butoxybenzamide IUPAC Name: N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxoethyl]-4-butoxybenzamide Traditional Name: 4-butoxy-N-[2-keto-2-[(N'E)-N'-piperonylidenehydrazino]ethyl]benzamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)NN=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H23N3O5/c1-2-3-10-27-17-7-5-16(6-8-17)21(26)22-13-20(25)24-23-12-15-4-9-18-19(11-15)29-14-28-18/h4-9,11-12H,2-3,10,13-14H2,1H3,(H,22,26)(H,24,25)/b23-12+