S-(4-methoxyphenyl) (3R)-3-(4-methoxyphenyl)-4-nitro-butanethioate

Systemtic Name: S-(4-methoxyphenyl) (3R)-3-(4-methoxyphenyl)-4-nitro-butanethioate Openeye Name: S-(4-methoxyphenyl) (3R)-3-(4-methoxyphenyl)-4-nitro-butanethioate CAS Name: (3R)-3-(4-methoxyphenyl)-4-nitrobutanethioic acid S-(4-methoxyphenyl) ester IUPAC Name: S-(4-methoxyphenyl) (3R)-3-(4-methoxyphenyl)-4-nitrobutanethioate Traditional Name: (3R)-3-(4-methoxyphenyl)-4-nitro-butanethioic acid S-(4-methoxyphenyl) ester Formula: C18H19NO5S MolecularWeight: 361.41216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)SC2=CC=C(C=C2)OC)C[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H](CC(=O)SC2=CC=C(C=C2)OC)C[N+](=O)[O-]

InChI

InChI=1S/C18H19NO5S/c1-23-15-5-3-13(4-6-15)14(12-19(21)22)11-18(20)25-17-9-7-16(24-2)8-10-17/h3-10,14H,11-12H2,1-2H3/t14-/m0/s1