3-(anthracen-2-ylcarbonylamino)-7-chloranyl-dibenzothiophene-2,8-dicarboxylic acid

Systemtic Name: 3-(anthracen-2-ylcarbonylamino)-7-chloranyl-dibenzothiophene-2,8-dicarboxylic acid Openeye Name: 3-(anthracene-2-carbonylamino)-7-chloro-dibenzothiophene-2,8-dicarboxylic acid CAS Name: 3-[[2-anthracenyl(oxo)methyl]amino]-7-chlorodibenzothiophene-2,8-dicarboxylic acid IUPAC Name: 3-(anthracene-2-carbonylamino)-7-chlorodibenzothiophene-2,8-dicarboxylic acid Traditional Name: 3-(anthracene-2-carbonylamino)-7-chloro-dibenzothiophene-2,8-dicarboxylic acid Formula: C29H16ClNO5S MolecularWeight: 525.95904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C=C(C=CC3=CC2=C1)C(=O)NC4=C(C=C5C6=CC(=C(C=C6SC5=C4)Cl)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C=C3C=C(C=CC3=CC2=C1)C(=O)NC4=C(C=C5C6=CC(=C(C=C6SC5=C4)Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C29H16ClNO5S/c30-23-12-25-19(10-21(23)28(33)34)20-11-22(29(35)36)24(13-26(20)37-25)31-27(32)17-6-5-16-7-14-3-1-2-4-15(14)8-18(16)9-17/h1-13H,(H,31,32)(H,33,34)(H,35,36)