N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-furylmethylamino)-2-oxo-ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2-furfurylamino)-2-keto-ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C20H24N4O7S MolecularWeight: 464.49216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NCC(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H24N4O7S/c1-14-4-5-16(24(27)28)11-18(14)32(29,30)23-8-6-15(7-9-23)20(26)22-13-19(25)21-12-17-3-2-10-31-17/h2-5,10-11,15H,6-9,12-13H2,1H3,(H,21,25)(H,22,26)