3-(4-methylsulfonyl-2-nitro-phenoxy)-N-(phenylmethyl)benzamide

Systemtic Name: 3-(4-methylsulfonyl-2-nitro-phenoxy)-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-(4-methylsulfonyl-2-nitro-phenoxy)benzamide CAS Name: 3-(4-methylsulfonyl-2-nitrophenoxy)-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-(4-methylsulfonyl-2-nitrophenoxy)benzamide Traditional Name: N-benzyl-3-(4-mesyl-2-nitro-phenoxy)benzamide Formula: C21H18N2O6S MolecularWeight: 426.44242

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6S/c1-30(27,28)18-10-11-20(19(13-18)23(25)26)29-17-9-5-8-16(12-17)21(24)22-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,22,24)