6-tert-butyl-N-[(E)-[1-(3-cyanopropyl)-2-oxidanylidene-indol-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: 6-tert-butyl-N-[(E)-[1-(3-cyanopropyl)-2-oxidanylidene-indol-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: 6-tert-butyl-N-[(E)-[1-(3-cyanopropyl)-2-oxo-indolin-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: 6-tert-butyl-N-[(E)-[1-(3-cyanopropyl)-2-oxo-3-indolylidene]amino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: 6-tert-butyl-N-[(E)-[1-(3-cyanopropyl)-2-oxoindol-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: 6-tert-butyl-N-[(E)-[1-(3-cyanopropyl)-2-keto-indolin-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)NN=C3C4=CC=CC=C4N(C3=O)CCCC#N

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)N/N=C/3\C4=CC=CC=C4N(C3=O)CCCC#N

InChI

InChI=1S/C25H26N4O4/c1-25(2,3)16-10-11-19-20(14-16)33-21(15-32-19)23(30)28-27-22-17-8-4-5-9-18(17)29(24(22)31)13-7-6-12-26/h4-5,8-11,14,21H,6-7,13,15H2,1-3H3,(H,28,30)/b27-22+