[4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[(E)-3-(2-thienyl)prop-2-enoyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(E)-3-(2-thienyl)acryloyl]phenyl] ester Formula: C20H13NO5S MolecularWeight: 379.38592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=CC=C(C=C2)C(=O)C=CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=CC=C(C=C2)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C20H13NO5S/c22-19(11-10-18-5-2-12-27-18)14-6-8-17(9-7-14)26-20(23)15-3-1-4-16(13-15)21(24)25/h1-13H/b11-10+