4-[2-methyl-4-[(E)-3-(1-methylidenethiophen-2-yl)prop-2-enoyl]oxy-1H-imidazol-5-yl]benzoic acid

Systemtic Name: 4-[2-methyl-4-[(E)-3-(1-methylidenethiophen-2-yl)prop-2-enoyl]oxy-1H-imidazol-5-yl]benzoic acid Openeye Name: 4-[2-methyl-4-[(E)-3-(1-methylene-2-thienyl)prop-2-enoyl]oxy-1H-imidazol-5-yl]benzoic acid CAS Name: 4-[2-methyl-4-[(E)-3-(1-methylene-2-thiophenyl)-1-oxoprop-2-enoxy]-1H-imidazol-5-yl]benzoic acid IUPAC Name: 4-[2-methyl-4-[(E)-3-(1-methylidenethiophen-2-yl)prop-2-enoyl]oxy-1H-imidazol-5-yl]benzoic acid Traditional Name: 4-[2-methyl-4-[(E)-3-(1-methylene-2-thienyl)acryloyl]oxy-1H-imidazol-5-yl]benzoic acid Formula: C19H16N2O4S MolecularWeight: 368.40634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1)C2=CC=C(C=C2)C(=O)O)OC(=O)C=CC3=CC=CS3=C

Isomeric SMILES

CC1=NC(=C(N1)C2=CC=C(C=C2)C(=O)O)OC(=O)/C=C/C3=CC=CS3=C

InChI

InChI=1S/C19H16N2O4S/c1-12-20-17(13-5-7-14(8-6-13)19(23)24)18(21-12)25-16(22)10-9-15-4-3-11-26(15)2/h3-11H,2H2,1H3,(H,20,21)(H,23,24)/b10-9+