S-(4-nitrophenyl) (E)-3-(4-hexoxyphenyl)prop-2-enethioate

Systemtic Name: S-(4-nitrophenyl) (E)-3-(4-hexoxyphenyl)prop-2-enethioate Openeye Name: S-(4-nitrophenyl) (E)-3-(4-hexoxyphenyl)prop-2-enethioate CAS Name: (E)-3-(4-hexoxyphenyl)-2-propenethioic acid S-(4-nitrophenyl) ester IUPAC Name: S-(4-nitrophenyl) (E)-3-(4-hexoxyphenyl)prop-2-enethioate Traditional Name: (E)-3-(4-hexoxyphenyl)prop-2-enethioic acid S-(4-nitrophenyl) ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=CC(=O)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=C/C(=O)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H23NO4S/c1-2-3-4-5-16-26-19-11-6-17(7-12-19)8-15-21(23)27-20-13-9-18(10-14-20)22(24)25/h6-15H,2-5,16H2,1H3/b15-8+