1-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]dibenzothiophene-2,8-dicarboxylic acid

Systemtic Name: 1-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]dibenzothiophene-2,8-dicarboxylic acid Openeye Name: 1-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]dibenzothiophene-2,8-dicarboxylic acid CAS Name: 1-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]dibenzothiophene-2,8-dicarboxylic acid IUPAC Name: 1-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]dibenzothiophene-2,8-dicarboxylic acid Traditional Name: 1-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]dibenzothiophene-2,8-dicarboxylic acid Formula: C24H17NO6S MolecularWeight: 447.45988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC2=C(C=CC3=C2C4=C(S3)C=CC(=C4)C(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC2=C(C=CC3=C2C4=C(S3)C=CC(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C24H17NO6S/c1-31-15-6-2-13(3-7-15)4-11-20(26)25-22-16(24(29)30)8-10-19-21(22)17-12-14(23(27)28)5-9-18(17)32-19/h2-12H,1H3,(H,25,26)(H,27,28)(H,29,30)/b11-4+