5-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-2-butyl-isoindole-1,3-dione

Systemtic Name: 5-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-2-butyl-isoindole-1,3-dione Openeye Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-butyl-isoindoline-1,3-dione CAS Name: 5-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-2-butylisoindole-1,3-dione IUPAC Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-butylisoindole-1,3-dione Traditional Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-2-butyl-isoindoline-1,3-quinone Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H33N3O4/c1-2-3-14-28-24(31)20-9-8-19(17-21(20)25(28)32)23(30)27-15-10-18(11-16-27)22(29)26-12-6-4-5-7-13-26/h8-9,17-18H,2-7,10-16H2,1H3