[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-(2-nitrophenyl)prop-2-enoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-(2-nitrophenyl)prop-2-enoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 3-(2-nitrophenyl)prop-2-enoate CAS Name: 3-(2-nitrophenyl)-2-propenoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 3-(2-nitrophenyl)prop-2-enoate Traditional Name: 3-(2-nitrophenyl)acrylic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C15H10BrNO5S MolecularWeight: 396.2126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)OCC(=O)C2=CC=C(S2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C=CC(=O)OCC(=O)C2=CC=C(S2)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H10BrNO5S/c16-14-7-6-13(23-14)12(18)9-22-15(19)8-5-10-3-1-2-4-11(10)17(20)21/h1-8H,9H2