4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(3-nitrophenyl)benzamide

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(3-nitrophenyl)benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-(3-nitrophenyl)benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(3-nitrophenyl)benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(3-nitrophenyl)benzamide Traditional Name: 4-[(N-mesyl-3,4-dimethyl-anilino)methyl]-N-(3-nitrophenyl)benzamide Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O5S/c1-16-7-12-21(13-17(16)2)25(32(3,30)31)15-18-8-10-19(11-9-18)23(27)24-20-5-4-6-22(14-20)26(28)29/h4-14H,15H2,1-3H3,(H,24,27)