2-[[(Z)-3-(1-benzothiophen-5-yl)but-2-enoyl]amino]benzoic acid

Systemtic Name: 2-[[(Z)-3-(1-benzothiophen-5-yl)but-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(Z)-3-(benzothiophen-5-yl)but-2-enoyl]amino]benzoic acid CAS Name: 2-[[(Z)-3-(1-benzothiophen-5-yl)-1-oxobut-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(Z)-3-(1-benzothiophen-5-yl)but-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(Z)-3-(benzothiophen-5-yl)but-2-enoyl]amino]benzoic acid Formula: C19H15NO3S MolecularWeight: 337.3923

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC3=C(C=C2)SC=C3

Isomeric SMILES

C/C(=C/C(=O)NC1=CC=CC=C1C(=O)O)/C2=CC3=C(C=C2)SC=C3

InChI

InChI=1S/C19H15NO3S/c1-12(13-6-7-17-14(11-13)8-9-24-17)10-18(21)20-16-5-3-2-4-15(16)19(22)23/h2-11H,1H3,(H,20,21)(H,22,23)/b12-10-