N-[1-(4,5-dimethoxy-2-nitro-phenyl)carbonylpiperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-(4,5-dimethoxy-2-nitro-phenyl)carbonylpiperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-(4,5-dimethoxy-2-nitro-benzoyl)-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[(4,5-dimethoxy-2-nitrophenyl)-oxomethyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-(4,5-dimethoxy-2-nitrobenzoyl)piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-(4,5-dimethoxy-2-nitro-benzoyl)-4-piperidyl]thiophene-2-sulfonamide Formula: C18H21N3O7S2 MolecularWeight: 455.50524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H21N3O7S2/c1-27-15-10-13(14(21(23)24)11-16(15)28-2)18(22)20-7-5-12(6-8-20)19-30(25,26)17-4-3-9-29-17/h3-4,9-12,19H,5-8H2,1-2H3