2-[2,6-bis(oxidanylidene)piperidin-3-yl]-4-(3-phenylpropoxy)isoindole-1,3-dione

Systemtic Name: 2-[2,6-bis(oxidanylidene)piperidin-3-yl]-4-(3-phenylpropoxy)isoindole-1,3-dione Openeye Name: 2-(2,6-dioxo-3-piperidyl)-4-(3-phenylpropoxy)isoindoline-1,3-dione CAS Name: 2-(2,6-dioxo-3-piperidinyl)-4-(3-phenylpropoxy)isoindole-1,3-dione IUPAC Name: 2-(2,6-dioxopiperidin-3-yl)-4-(3-phenylpropoxy)isoindole-1,3-dione Traditional Name: 2-(2,6-diketo-3-piperidyl)-4-(3-phenylpropoxy)isoindoline-1,3-quinone Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)OCCCC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)OCCCC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O5/c25-18-12-11-16(20(26)23-18)24-21(27)15-9-4-10-17(19(15)22(24)28)29-13-5-8-14-6-2-1-3-7-14/h1-4,6-7,9-10,16H,5,8,11-13H2,(H,23,25,26)