2-[[2-oxidanyl-5-(2-phenylbenzo[e]indol-3-yl)phenyl]carbonylamino]ethanesulfonic acid

Systemtic Name: 2-[[2-oxidanyl-5-(2-phenylbenzo[e]indol-3-yl)phenyl]carbonylamino]ethanesulfonic acid Openeye Name: 2-[[2-hydroxy-5-(2-phenylbenzo[e]indol-3-yl)benzoyl]amino]ethanesulfonic acid CAS Name: 2-[[[2-hydroxy-5-(2-phenyl-3-benzo[e]indolyl)phenyl]-oxomethyl]amino]ethanesulfonic acid IUPAC Name: 2-[[2-hydroxy-5-(2-phenylbenzo[e]indol-3-yl)benzoyl]amino]ethanesulfonic acid Traditional Name: 2-[[2-hydroxy-5-(2-phenylbenz[e]indol-3-yl)benzoyl]amino]ethanesulfonic acid Formula: C27H22N2O5S MolecularWeight: 486.53898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(N2C4=CC(=C(C=C4)O)C(=O)NCCS(=O)(=O)O)C=CC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(N2C4=CC(=C(C=C4)O)C(=O)NCCS(=O)(=O)O)C=CC5=CC=CC=C53

InChI

InChI=1S/C27H22N2O5S/c30-26-13-11-20(16-23(26)27(31)28-14-15-35(32,33)34)29-24-12-10-18-6-4-5-9-21(18)22(24)17-25(29)19-7-2-1-3-8-19/h1-13,16-17,30H,14-15H2,(H,28,31)(H,32,33,34)