3-(2-nitro-4-piperidin-1-ylsulfonyl-phenoxy)-N-(phenylmethyl)benzamide

Systemtic Name: 3-(2-nitro-4-piperidin-1-ylsulfonyl-phenoxy)-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-[2-nitro-4-(1-piperidylsulfonyl)phenoxy]benzamide CAS Name: 3-[2-nitro-4-(1-piperidinylsulfonyl)phenoxy]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-(2-nitro-4-piperidin-1-ylsulfonylphenoxy)benzamide Traditional Name: N-benzyl-3-(2-nitro-4-piperidinosulfonyl-phenoxy)benzamide Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H25N3O6S/c29-25(26-18-19-8-3-1-4-9-19)20-10-7-11-21(16-20)34-24-13-12-22(17-23(24)28(30)31)35(32,33)27-14-5-2-6-15-27/h1,3-4,7-13,16-17H,2,5-6,14-15,18H2,(H,26,29)