N-methyl-N-[(5-methylfuran-2-yl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-methyl-N-[(5-methyl-2-furyl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-methyl-N-[(5-methyl-2-furanyl)methyl]-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-methyl-N-[(5-methylfuran-2-yl)methyl]-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-methyl-N-[(5-methyl-2-furyl)methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C20H25N3O6S MolecularWeight: 435.494

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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)N(C)CC3=CC=C(O3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(O3)C

InChI

InChI=1S/C20H25N3O6S/c1-14-4-6-17(23(25)26)12-19(14)30(27,28)22-10-8-16(9-11-22)20(24)21(3)13-18-7-5-15(2)29-18/h4-7,12,16H,8-11,13H2,1-3H3