N-[2-chloranyl-4-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[2-chloranyl-4-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[2-chloro-4-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[2-chloro-4-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]phenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[2-chloro-4-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]phenyl]-3-methylsulfonylbenzamide Traditional Name: N-[2-chloro-4-[[(E)-3-(3-nitrophenyl)acryloyl]amino]phenyl]-3-mesyl-benzamide Formula: C23H18ClN3O6S MolecularWeight: 499.92352

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H18ClN3O6S/c1-34(32,33)19-7-3-5-16(13-19)23(29)26-21-10-9-17(14-20(21)24)25-22(28)11-8-15-4-2-6-18(12-15)27(30)31/h2-14H,1H3,(H,25,28)(H,26,29)/b11-8+