(E)-3-(4-cyclohexylsulfanyl-3-nitro-phenyl)prop-2-enoate

Systemtic Name: (E)-3-(4-cyclohexylsulfanyl-3-nitro-phenyl)prop-2-enoate Openeye Name: (E)-3-(4-cyclohexylsulfanyl-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-3-[4-(cyclohexylthio)-3-nitrophenyl]-2-propenoate IUPAC Name: (E)-3-(4-cyclohexylsulfanyl-3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-[4-(cyclohexylthio)-3-nitro-phenyl]acrylate Formula: C15H16NO4S- MolecularWeight: 306.35684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=C(C=C(C=C2)C=CC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)SC2=C(C=C(C=C2)/C=C/C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H17NO4S/c17-15(18)9-7-11-6-8-14(13(10-11)16(19)20)21-12-4-2-1-3-5-12/h6-10,12H,1-5H2,(H,17,18)/p-1/b9-7+