5-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid

Systemtic Name: 5-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid Openeye Name: 5-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid CAS Name: 5-[[(E)-3-(3-bromophenyl)-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-[[(E)-3-(3-bromophenyl)acryloyl]amino]-2-thenoic acid Formula: C14H10BrNO3S MolecularWeight: 352.2031

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C=CC(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)/C=C/C(=O)NC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C14H10BrNO3S/c15-10-3-1-2-9(8-10)4-6-12(17)16-13-7-5-11(20-13)14(18)19/h1-8H,(H,16,17)(H,18,19)/b6-4+