N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-2-(2-nitrophenoxy)acetamide Traditional Name: N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-2-(2-nitrophenoxy)acetamide Formula: C21H25N3O7S MolecularWeight: 463.5041

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O7S/c1-2-30-19-11-10-16(32(28,29)23-12-6-3-7-13-23)14-17(19)22-21(25)15-31-20-9-5-4-8-18(20)24(26)27/h4-5,8-11,14H,2-3,6-7,12-13,15H2,1H3,(H,22,25)