2-[2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-(azepane-1-carbonyl)-1-piperidyl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-[4-(azepane-1-carbonyl)piperidino]-2-keto-ethyl]isoindoline-1,3-quinone Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H27N3O4/c26-19(15-25-21(28)17-7-3-4-8-18(17)22(25)29)23-13-9-16(10-14-23)20(27)24-11-5-1-2-6-12-24/h3-4,7-8,16H,1-2,5-6,9-15H2