methyl 3-[(E)-3-thiophen-2-ylprop-2-enoyl]azulene-1-carboxylate

Systemtic Name: methyl 3-[(E)-3-thiophen-2-ylprop-2-enoyl]azulene-1-carboxylate Openeye Name: methyl 3-[(E)-3-(2-thienyl)prop-2-enoyl]azulene-1-carboxylate CAS Name: 3-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-1-azulenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-3-thiophen-2-ylprop-2-enoyl]azulene-1-carboxylate Traditional Name: 3-[(E)-3-(2-thienyl)acryloyl]azulene-1-carboxylic acid methyl ester Formula: C19H14O3S MolecularWeight: 322.37766

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C=CC=CC=C2C(=C1)C(=O)C=CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=C2C=CC=CC=C2C(=C1)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C19H14O3S/c1-22-19(21)17-12-16(14-7-3-2-4-8-15(14)17)18(20)10-9-13-6-5-11-23-13/h2-12H,1H3/b10-9+