ethyl 4-[[4-(1-adamantyl)phenyl]sulfamoyl]benzoate

Systemtic Name: ethyl 4-[[4-(1-adamantyl)phenyl]sulfamoyl]benzoate Openeye Name: ethyl 4-[[4-(1-adamantyl)phenyl]sulfamoyl]benzoate CAS Name: 4-[[4-(1-adamantyl)phenyl]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(1-adamantyl)phenyl]sulfamoyl]benzoate Traditional Name: 4-[[4-(1-adamantyl)phenyl]sulfamoyl]benzoic acid ethyl ester Formula: C25H29NO4S MolecularWeight: 439.56706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H29NO4S/c1-2-30-24(27)20-3-9-23(10-4-20)31(28,29)26-22-7-5-21(6-8-22)25-14-17-11-18(15-25)13-19(12-17)16-25/h3-10,17-19,26H,2,11-16H2,1H3