sodium 2-[(E)-2-(4-acetamidophenyl)ethenyl]-5-nitro-benzenesulfonic acid

Systemtic Name: sodium 2-[(E)-2-(4-acetamidophenyl)ethenyl]-5-nitro-benzenesulfonic acid Openeye Name: sodium 2-[(E)-2-(4-acetamidophenyl)vinyl]-5-nitro-benzenesulfonic acid CAS Name: sodium 2-[(E)-2-(4-acetamidophenyl)ethenyl]-5-nitrobenzenesulfonic acid IUPAC Name: sodium 2-[(E)-2-(4-acetamidophenyl)ethenyl]-5-nitrobenzenesulfonic acid Traditional Name: sodium 2-[(E)-2-(4-acetamidophenyl)vinyl]-5-nitro-besylic acid Formula: C16H14N2NaO6S+ MolecularWeight: 385.34693

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)/C=C/C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O.[Na+]

InChI

InChI=1S/C16H14N2O6S.Na/c1-11(19)17-14-7-3-12(4-8-14)2-5-13-6-9-15(18(20)21)10-16(13)25(22,23)24;/h2-10H,1H3,(H,17,19)(H,22,23,24);/q;+1/b5-2+;