4-[(4-methylphenyl)sulfonylmethyl]-N-(3-nitrophenyl)benzamide

Systemtic Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-(3-nitrophenyl)benzamide Openeye Name: N-(3-nitrophenyl)-4-(p-tolylsulfonylmethyl)benzamide CAS Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-(3-nitrophenyl)benzamide IUPAC Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-(3-nitrophenyl)benzamide Traditional Name: N-(3-nitrophenyl)-4-(tosylmethyl)benzamide Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O5S/c1-15-5-11-20(12-6-15)29(27,28)14-16-7-9-17(10-8-16)21(24)22-18-3-2-4-19(13-18)23(25)26/h2-13H,14H2,1H3,(H,22,24)