4-[(4-methylphenyl)sulfonylmethyl]-N-[2-[(2-nitrophenyl)amino]ethyl]benzamide

Systemtic Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-[2-[(2-nitrophenyl)amino]ethyl]benzamide Openeye Name: N-[2-(2-nitroanilino)ethyl]-4-(p-tolylsulfonylmethyl)benzamide CAS Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-[2-(2-nitroanilino)ethyl]benzamide IUPAC Name: 4-[(4-methylphenyl)sulfonylmethyl]-N-[2-(2-nitroanilino)ethyl]benzamide Traditional Name: N-[2-(2-nitroanilino)ethyl]-4-(tosylmethyl)benzamide Formula: C23H23N3O5S MolecularWeight: 453.51082

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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)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O5S/c1-17-6-12-20(13-7-17)32(30,31)16-18-8-10-19(11-9-18)23(27)25-15-14-24-21-4-2-3-5-22(21)26(28)29/h2-13,24H,14-16H2,1H3,(H,25,27)