(E)-[(E)-2-(4-acetamidophenyl)-3-(4-methylsulfonylphenyl)prop-2-enoyl]oxymethoxyimino-oxidanidyl-pyrrolidin-1-yl-azanium

Systemtic Name: (E)-[(E)-2-(4-acetamidophenyl)-3-(4-methylsulfonylphenyl)prop-2-enoyl]oxymethoxyimino-oxidanidyl-pyrrolidin-1-yl-azanium Openeye Name: (E)-[(E)-2-(4-acetamidophenyl)-3-(4-methylsulfonylphenyl)prop-2-enoyl]oxymethoxyimino-oxido-pyrrolidin-1-yl-ammonium CAS Name: (E)-[(E)-2-(4-acetamidophenyl)-3-(4-methylsulfonylphenyl)-1-oxoprop-2-enoxy]methoxyimino-oxido-(1-pyrrolidinyl)ammonium IUPAC Name: (E)-[(E)-2-(4-acetamidophenyl)-3-(4-methylsulfonylphenyl)prop-2-enoyl]oxymethoxyimino-oxido-pyrrolidin-1-ylazanium Traditional Name: (E)-[(E)-2-(4-acetamidophenyl)-3-(4-mesylphenyl)acryloyl]oxymethyloximino-oxido-pyrrolidino-ammonium Formula: C23H26N4O7S MolecularWeight: 502.54014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=CC2=CC=C(C=C2)S(=O)(=O)C)C(=O)OCON=[N+](N3CCCC3)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)/C(=C\C2=CC=C(C=C2)S(=O)(=O)C)/C(=O)OCO/N=[N+](\N3CCCC3)/[O-]

InChI

InChI=1S/C23H26N4O7S/c1-17(28)24-20-9-7-19(8-10-20)22(15-18-5-11-21(12-6-18)35(2,31)32)23(29)33-16-34-25-27(30)26-13-3-4-14-26/h5-12,15H,3-4,13-14,16H2,1-2H3,(H,24,28)/b22-15+,27-25+