ethyl 1-[3-(diethylamino)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(diethylamino)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[[3-(diethylamino)-1,4-dioxo-2-naphthyl]sulfonyl]piperidine-4-carboxylate CAS Name: 1-[[3-(diethylamino)-1,4-dioxo-2-naphthalenyl]sulfonyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(diethylamino)-1,4-dioxonaphthalen-2-yl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[[3-(diethylamino)-1,4-diketo-2-naphthyl]sulfonyl]isonipecotic acid ethyl ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCN(CC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C22H28N2O6S/c1-4-23(5-2)18-19(25)16-9-7-8-10-17(16)20(26)21(18)31(28,29)24-13-11-15(12-14-24)22(27)30-6-3/h7-10,15H,4-6,11-14H2,1-3H3