2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)-N-(2-pyrrolidin-1-ylphenyl)isoindole-5-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)-N-(2-pyrrolidin-1-ylphenyl)isoindole-5-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-(2-pyrrolidin-1-ylphenyl)isoindoline-5-carboxamide CAS Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-[2-(1-pyrrolidinyl)phenyl]-5-isoindolecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-1,3-dioxo-N-(2-pyrrolidin-1-ylphenyl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-2-p-phenetyl-N-(2-pyrrolidinophenyl)isoindoline-5-carboxamide Formula: C27H25N3O4 MolecularWeight: 455.5051

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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=CC=C4N5CCCC5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC=C4N5CCCC5

InChI

InChI=1S/C27H25N3O4/c1-2-34-20-12-10-19(11-13-20)30-26(32)21-14-9-18(17-22(21)27(30)33)25(31)28-23-7-3-4-8-24(23)29-15-5-6-16-29/h3-4,7-14,17H,2,5-6,15-16H2,1H3,(H,28,31)