4-[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylpiperazine-1-carbaldehyde Openeye Name: 4-(1,3-dioxo-2-phenethyl-isoindoline-5-carbonyl)piperazine-1-carbaldehyde CAS Name: 4-[(1,3-dioxo-2-phenethyl-5-isoindolyl)-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-(1,3-dioxo-2-phenethylisoindole-5-carbonyl)piperazine-1-carbaldehyde Traditional Name: 4-(1,3-diketo-2-phenethyl-isoindoline-5-carbonyl)piperazine-1-carbaldehyde Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C=O)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O4/c26-15-23-10-12-24(13-11-23)20(27)17-6-7-18-19(14-17)22(29)25(21(18)28)9-8-16-4-2-1-3-5-16/h1-7,14-15H,8-13H2