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

Systemtic Name: N-[[1-(3-cyanopropyl)-2-oxidanylidene-indol-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[[1-(3-cyanopropyl)-2-oxo-indolin-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[[1-(3-cyanopropyl)-2-oxo-3-indolylidene]amino]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[[1-(3-cyanopropyl)-2-oxoindol-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[[1-(3-cyanopropyl)-2-keto-indolin-3-ylidene]amino]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C21H18N4O4 MolecularWeight: 390.39202

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)NN=C3C4=CC=CC=C4N(C3=O)CCCC#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)NN=C3C4=CC=CC=C4N(C3=O)CCCC#N

InChI

InChI=1S/C21H18N4O4/c22-9-3-4-10-25-16-6-2-1-5-15(16)19(21(25)27)23-24-20(26)14-7-8-17-18(13-14)29-12-11-28-17/h1-2,5-8,13H,3-4,10-12H2,(H,24,26)