2-[2-(1-methylpiperidin-4-yl)ethyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(1-methylpiperidin-4-yl)ethyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(1-methyl-4-piperidyl)ethyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(1-methyl-4-piperidinyl)ethyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(1-methylpiperidin-4-yl)ethyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[2-(1-methyl-4-piperidyl)ethyl]-5-nitro-isoindoline-1,3-quinone Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCC(CC1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4/c1-17-7-4-11(5-8-17)6-9-18-15(20)13-3-2-12(19(22)23)10-14(13)16(18)21/h2-3,10-11H,4-9H2,1H3