ethyl 5-[4-[2-[(4-nitrophenyl)amino]ethylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-[2-[(4-nitrophenyl)amino]ethylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-[[4-[2-(4-nitroanilino)ethylcarbamoyl]-1-piperidyl]sulfonyl]furan-2-carboxylate CAS Name: 5-[[4-[[2-(4-nitroanilino)ethylamino]-oxomethyl]-1-piperidinyl]sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-[2-(4-nitroanilino)ethylcarbamoyl]piperidin-1-yl]sulfonylfuran-2-carboxylate Traditional Name: 5-[4-[2-(4-nitroanilino)ethylcarbamoyl]piperidino]sulfonylfuran-2-carboxylic acid ethyl ester Formula: C21H26N4O8S MolecularWeight: 494.51814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCC(CC2)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O8S/c1-2-32-21(27)18-7-8-19(33-18)34(30,31)24-13-9-15(10-14-24)20(26)23-12-11-22-16-3-5-17(6-4-16)25(28)29/h3-8,15,22H,2,9-14H2,1H3,(H,23,26)