methyl 1-[1-(4-iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[1-(4-iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidine-4-carboxylate Openeye Name: methyl 1-[1-(4-iodophenyl)-2,5-dioxo-pyrrolidin-3-yl]piperidine-4-carboxylate CAS Name: 1-[1-(4-iodophenyl)-2,5-dioxo-3-pyrrolidinyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxylate Traditional Name: 1-[1-(4-iodophenyl)-2,5-diketo-pyrrolidin-3-yl]isonipecotic acid methyl ester Formula: C17H19IN2O4 MolecularWeight: 442.24823

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C2CC(=O)N(C2=O)C3=CC=C(C=C3)I

Isomeric SMILES

COC(=O)C1CCN(CC1)C2CC(=O)N(C2=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C17H19IN2O4/c1-24-17(23)11-6-8-19(9-7-11)14-10-15(21)20(16(14)22)13-4-2-12(18)3-5-13/h2-5,11,14H,6-10H2,1H3