(E)-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-3-(3-nitrophenyl)acrylamide Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O6S/c1-2-31-21-11-10-19(32(29,30)24-13-4-3-5-14-24)16-20(21)23-22(26)12-9-17-7-6-8-18(15-17)25(27)28/h6-12,15-16H,2-5,13-14H2,1H3,(H,23,26)/b12-9+