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

Systemtic Name: ethyl 1-[1-(4-butoxycarbonylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[1-(4-butoxycarbonylphenyl)-2,5-dioxo-pyrrolidin-3-yl]piperidine-3-carboxylate CAS Name: 1-[1-[4-[butoxy(oxo)methyl]phenyl]-2,5-dioxo-3-pyrrolidinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-butoxycarbonylphenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-3-carboxylate Traditional Name: 1-[1-(4-butoxycarbonylphenyl)-2,5-diketo-pyrrolidin-3-yl]nipecotic acid ethyl ester Formula: C23H30N2O6 MolecularWeight: 430.4941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCCC(C3)C(=O)OCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCCC(C3)C(=O)OCC

InChI

InChI=1S/C23H30N2O6/c1-3-5-13-31-22(28)16-8-10-18(11-9-16)25-20(26)14-19(21(25)27)24-12-6-7-17(15-24)23(29)30-4-2/h8-11,17,19H,3-7,12-15H2,1-2H3