N-(3-cyclopentylsulfonylphenyl)-4-methoxy-3-nitro-benzamide

Systemtic Name: N-(3-cyclopentylsulfonylphenyl)-4-methoxy-3-nitro-benzamide Openeye Name: N-(3-cyclopentylsulfonylphenyl)-4-methoxy-3-nitro-benzamide CAS Name: N-(3-cyclopentylsulfonylphenyl)-4-methoxy-3-nitrobenzamide IUPAC Name: N-(3-cyclopentylsulfonylphenyl)-4-methoxy-3-nitrobenzamide Traditional Name: N-(3-cyclopentylsulfonylphenyl)-4-methoxy-3-nitro-benzamide Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)C3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)C3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6S/c1-27-18-10-9-13(11-17(18)21(23)24)19(22)20-14-5-4-8-16(12-14)28(25,26)15-6-2-3-7-15/h4-5,8-12,15H,2-3,6-7H2,1H3,(H,20,22)