2-(4-ethoxyphenyl)-N-[4-(3-methylbutanoylamino)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-N-[4-(3-methylbutanoylamino)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-N-[4-(3-methylbutanoylamino)phenyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(4-ethoxyphenyl)-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-N-[4-(3-methylbutanoylamino)phenyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[4-(isovalerylamino)phenyl]-1,3-diketo-2-p-phenetyl-isoindoline-5-carboxamide Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=C(C=C4)NC(=O)CC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=C(C=C4)NC(=O)CC(C)C

InChI

InChI=1S/C28H27N3O5/c1-4-36-22-12-10-21(11-13-22)31-27(34)23-14-5-18(16-24(23)28(31)35)26(33)30-20-8-6-19(7-9-20)29-25(32)15-17(2)3/h5-14,16-17H,4,15H2,1-3H3,(H,29,32)(H,30,33)