ethanoic acid; 2-(2-piperidin-2-ylethyl)isoindole-1,3-dione

Systemtic Name: ethanoic acid; 2-(2-piperidin-2-ylethyl)isoindole-1,3-dione Openeye Name: acetic acid; 2-[2-(2-piperidyl)ethyl]isoindoline-1,3-dione CAS Name: acetic acid; 2-[2-(2-piperidinyl)ethyl]isoindole-1,3-dione IUPAC Name: acetic acid; 2-(2-piperidin-2-ylethyl)isoindole-1,3-dione Traditional Name: acetic acid; 2-[2-(2-piperidyl)ethyl]isoindoline-1,3-quinone Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CCNC(C1)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(=O)O.C1CCNC(C1)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C15H18N2O2.C2H4O2/c18-14-12-6-1-2-7-13(12)15(19)17(14)10-8-11-5-3-4-9-16-11;1-2(3)4/h1-2,6-7,11,16H,3-5,8-10H2;1H3,(H,3,4)