(E)-2-(4-bromophenyl)sulfonyl-3-(4-methyl-3-nitro-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-methyl-3-nitro-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-methyl-3-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-methyl-3-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-methyl-3-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-brosyl-3-(4-methyl-3-nitro-phenyl)acrylonitrile Formula: C16H11BrN2O4S MolecularWeight: 407.23854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H11BrN2O4S/c1-11-2-3-12(9-16(11)19(20)21)8-15(10-18)24(22,23)14-6-4-13(17)5-7-14/h2-9H,1H3/b15-8+