(3S,6R,7S)-6-hexyl-N7-oxidanyl-5-oxidanylidene-N3-[2-(4-sulfamoylphenyl)ethyl]-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3,7-dicarboxamide

Systemtic Name: (3S,6R,7S)-6-hexyl-N7-oxidanyl-5-oxidanylidene-N3-[2-(4-sulfamoylphenyl)ethyl]-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3,7-dicarboxamide Openeye Name: (3S,6R,7S)-6-hexyl-7-(hydroxycarbamoyl)-5-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3-carboxamide CAS Name: (3S,6R,7S)-6-hexyl-N7-hydroxy-5-oxo-N3-[2-(4-sulfamoylphenyl)ethyl]-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3,7-dicarboxamide IUPAC Name: (3S,6R,7S)-6-hexyl-7-N-hydroxy-5-oxo-3-N-[2-(4-sulfamoylphenyl)ethyl]-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3,7-dicarboxamide Traditional Name: (3S,6R,7S)-6-hexyl-7-(hydroxycarbamoyl)-5-keto-N-[2-(4-sulfamoylphenyl)ethyl]-11-oxa-4-azabicyclo[10.2.2]hexadeca-1(14),12,15-triene-3-carboxamide Formula: C30H42N4O7S MolecularWeight: 602.74208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(CCCOC2=CC=C(CC(NC1=O)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)C=C2)C(=O)NO

Isomeric SMILES

CCCCCC[C@@H]1[C@H](CCCOC2=CC=C(C[C@H](NC1=O)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)C=C2)C(=O)NO

InChI

InChI=1S/C30H42N4O7S/c1-2-3-4-5-7-25-26(29(36)34-38)8-6-19-41-23-13-9-22(10-14-23)20-27(33-28(25)35)30(37)32-18-17-21-11-15-24(16-12-21)42(31,39)40/h9-16,25-27,38H,2-8,17-20H2,1H3,(H,32,37)(H,33,35)(H,34,36)(H2,31,39,40)/t25-,26+,27+/m1/s1