[(1R)-1-(3-nitrophenyl)ethyl] (E)-3-(5-methylthiophen-2-yl)prop-2-enoate

Systemtic Name: [(1R)-1-(3-nitrophenyl)ethyl] (E)-3-(5-methylthiophen-2-yl)prop-2-enoate Openeye Name: [(1R)-1-(3-nitrophenyl)ethyl] (E)-3-(5-methyl-2-thienyl)prop-2-enoate CAS Name: (E)-3-(5-methyl-2-thiophenyl)-2-propenoic acid [(1R)-1-(3-nitrophenyl)ethyl] ester IUPAC Name: [(1R)-1-(3-nitrophenyl)ethyl] (E)-3-(5-methylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-methyl-2-thienyl)acrylic acid [(1R)-1-(3-nitrophenyl)ethyl] ester Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)OC(C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)O[C@H](C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO4S/c1-11-6-7-15(22-11)8-9-16(18)21-12(2)13-4-3-5-14(10-13)17(19)20/h3-10,12H,1-2H3/b9-8+/t12-/m1/s1