4-[6,6-dimethyl-2,4-bis(oxidanylidene)piperidin-3-yl]carbonyl-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[6,6-dimethyl-2,4-bis(oxidanylidene)piperidin-3-yl]carbonyl-3-nitro-benzenecarbonitrile Openeye Name: 4-(6,6-dimethyl-2,4-dioxo-piperidine-3-carbonyl)-3-nitro-benzonitrile CAS Name: 4-[(6,6-dimethyl-2,4-dioxo-3-piperidinyl)-oxomethyl]-3-nitrobenzonitrile IUPAC Name: 4-(6,6-dimethyl-2,4-dioxopiperidine-3-carbonyl)-3-nitrobenzonitrile Traditional Name: 4-(2,4-diketo-6,6-dimethyl-nipecotoyl)-3-nitro-benzonitrile Formula: C15H13N3O5 MolecularWeight: 315.28082

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)N1)C(=O)C2=C(C=C(C=C2)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(=O)C(C(=O)N1)C(=O)C2=C(C=C(C=C2)C#N)[N+](=O)[O-])C

InChI

InChI=1S/C15H13N3O5/c1-15(2)6-11(19)12(14(21)17-15)13(20)9-4-3-8(7-16)5-10(9)18(22)23/h3-5,12H,6H2,1-2H3,(H,17,21)