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

Systemtic Name: ethyl 4-[6,6-dimethyl-2,4-bis(oxidanylidene)piperidin-3-yl]carbonyl-3-nitro-benzoate Openeye Name: ethyl 4-(6,6-dimethyl-2,4-dioxo-piperidine-3-carbonyl)-3-nitro-benzoate CAS Name: 4-[(6,6-dimethyl-2,4-dioxo-3-piperidinyl)-oxomethyl]-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-(6,6-dimethyl-2,4-dioxopiperidine-3-carbonyl)-3-nitrobenzoate Traditional Name: 4-(2,4-diketo-6,6-dimethyl-nipecotoyl)-3-nitro-benzoic acid ethyl ester Formula: C17H18N2O7 MolecularWeight: 362.33402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CC(NC2=O)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C(=O)C2C(=O)CC(NC2=O)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O7/c1-4-26-16(23)9-5-6-10(11(7-9)19(24)25)14(21)13-12(20)8-17(2,3)18-15(13)22/h5-7,13H,4,8H2,1-3H3,(H,18,22)