1-(4-tert-butylphenyl)sulfonyl-4-phenyl-azepan-4-ol

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-4-phenyl-azepan-4-ol Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-4-phenyl-azepan-4-ol CAS Name: 1-(4-tert-butylphenyl)sulfonyl-4-phenyl-4-azepanol IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-4-phenylazepan-4-ol Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-4-phenyl-azepan-4-ol Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCC(CC2)(C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCC(CC2)(C3=CC=CC=C3)O

InChI

InChI=1S/C22H29NO3S/c1-21(2,3)18-10-12-20(13-11-18)27(25,26)23-16-7-14-22(24,15-17-23)19-8-5-4-6-9-19/h4-6,8-13,24H,7,14-17H2,1-3H3