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

Systemtic Name: N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxidanylidene-ethyl]-4-tert-butyl-benzamide Openeye Name: N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylene)hydrazino]-2-oxo-ethyl]-4-tert-butyl-benzamide CAS Name: N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxoethyl]-4-tert-butylbenzamide IUPAC Name: N-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxoethyl]-4-tert-butylbenzamide Traditional Name: 4-tert-butyl-N-[2-keto-2-[(N'E)-N'-piperonylidenehydrazino]ethyl]benzamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4/c1-21(2,3)16-7-5-15(6-8-16)20(26)22-12-19(25)24-23-11-14-4-9-17-18(10-14)28-13-27-17/h4-11H,12-13H2,1-3H3,(H,22,26)(H,24,25)/b23-11+