N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: 2-allyl-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: 2-allyl-N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H18N2O5/c1-2-9-23-20(25)15-8-7-13(10-16(15)21(23)26)19(24)22-11-14-12-27-17-5-3-4-6-18(17)28-14/h2-8,10,14H,1,9,11-12H2,(H,22,24)/t14-/m0/s1