N-(2-methoxy-5-pentan-3-ylsulfonyl-phenyl)-9H-xanthene-9-carboxamide

Systemtic Name: N-(2-methoxy-5-pentan-3-ylsulfonyl-phenyl)-9H-xanthene-9-carboxamide Openeye Name: N-[5-(1-ethylpropylsulfonyl)-2-methoxy-phenyl]-9H-xanthene-9-carboxamide CAS Name: N-(2-methoxy-5-pentan-3-ylsulfonylphenyl)-9H-xanthene-9-carboxamide IUPAC Name: N-(2-methoxy-5-pentan-3-ylsulfonylphenyl)-9H-xanthene-9-carboxamide Traditional Name: N-[5-(1-ethylpropylsulfonyl)-2-methoxy-phenyl]-9H-xanthene-9-carboxamide Formula: C26H27NO5S MolecularWeight: 465.56128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

CCC(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C26H27NO5S/c1-4-17(5-2)33(29,30)18-14-15-24(31-3)21(16-18)27-26(28)25-19-10-6-8-12-22(19)32-23-13-9-7-11-20(23)25/h6-17,25H,4-5H2,1-3H3,(H,27,28)