N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-butyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-2-butyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-butyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-butyl-1,3-diketo-isoindoline-5-carboxamide Formula: C27H23N3O6 MolecularWeight: 485.48802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H23N3O6/c1-2-3-12-30-26(33)18-10-8-16(13-20(18)27(30)34)24(31)29-21-7-5-4-6-19(21)25(32)28-17-9-11-22-23(14-17)36-15-35-22/h4-11,13-14H,2-3,12,15H2,1H3,(H,28,32)(H,29,31)