S-(phenylmethyl) (E)-3-(3-nitrophenyl)prop-2-enethioate

Systemtic Name: S-(phenylmethyl) (E)-3-(3-nitrophenyl)prop-2-enethioate Openeye Name: S-benzyl (E)-3-(3-nitrophenyl)prop-2-enethioate CAS Name: (E)-3-(3-nitrophenyl)-2-propenethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl (E)-3-(3-nitrophenyl)prop-2-enethioate Traditional Name: (E)-3-(3-nitrophenyl)prop-2-enethioic acid S-benzyl ester Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO3S/c18-16(21-12-14-5-2-1-3-6-14)10-9-13-7-4-8-15(11-13)17(19)20/h1-11H,12H2/b10-9+