methyl 4-[[4-(1-adamantyl)phenyl]sulfonylamino]benzoate

Systemtic Name: methyl 4-[[4-(1-adamantyl)phenyl]sulfonylamino]benzoate Openeye Name: methyl 4-[[4-(1-adamantyl)phenyl]sulfonylamino]benzoate CAS Name: 4-[[4-(1-adamantyl)phenyl]sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(1-adamantyl)phenyl]sulfonylamino]benzoate Traditional Name: 4-[[4-(1-adamantyl)phenyl]sulfonylamino]benzoic acid methyl ester Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H27NO4S/c1-29-23(26)19-2-6-21(7-3-19)25-30(27,28)22-8-4-20(5-9-22)24-13-16-10-17(14-24)12-18(11-16)15-24/h2-9,16-18,25H,10-15H2,1H3