N-(3-azanyl-1-oxidanyl-3-oxidanylidene-propyl)-3-[7-(dibutylsulfamoyl)-9-oxidanylidene-xanthen-2-yl]-3-oxidanyl-propanamide

Systemtic Name: N-(3-azanyl-1-oxidanyl-3-oxidanylidene-propyl)-3-[7-(dibutylsulfamoyl)-9-oxidanylidene-xanthen-2-yl]-3-oxidanyl-propanamide Openeye Name: N-(3-amino-1-hydroxy-3-oxo-propyl)-3-[7-(dibutylsulfamoyl)-9-oxo-xanthen-2-yl]-3-hydroxy-propanamide CAS Name: N-(3-amino-1-hydroxy-3-oxopropyl)-3-[7-(dibutylsulfamoyl)-9-oxo-2-xanthenyl]-3-hydroxypropanamide IUPAC Name: N-(3-amino-1-hydroxy-3-oxopropyl)-3-[7-(dibutylsulfamoyl)-9-oxoxanthen-2-yl]-3-hydroxypropanamide Traditional Name: N-(3-amino-1-hydroxy-3-keto-propyl)-3-[7-(dibutylsulfamoyl)-9-keto-xanthen-2-yl]-3-hydroxy-propionamide Formula: C27H35N3O8S MolecularWeight: 561.6471

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)S(=O)(=O)C1=CC2=C(C=C1)OC3=C(C2=O)C=C(C=C3)C(CC(=O)NC(CC(=O)N)O)O

Isomeric SMILES

CCCCN(CCCC)S(=O)(=O)C1=CC2=C(C=C1)OC3=C(C2=O)C=C(C=C3)C(CC(=O)NC(CC(=O)N)O)O

InChI

InChI=1S/C27H35N3O8S/c1-3-5-11-30(12-6-4-2)39(36,37)18-8-10-23-20(14-18)27(35)19-13-17(7-9-22(19)38-23)21(31)15-25(33)29-26(34)16-24(28)32/h7-10,13-14,21,26,31,34H,3-6,11-12,15-16H2,1-2H3,(H2,28,32)(H,29,33)