(3S)-3-[(2S)-butan-2-yl]-4-(4-methylphenyl)sulfonyl-1,4-oxazepan-7-ol

Systemtic Name: (3S)-3-[(2S)-butan-2-yl]-4-(4-methylphenyl)sulfonyl-1,4-oxazepan-7-ol Openeye Name: (3S)-3-[(1S)-1-methylpropyl]-4-(p-tolylsulfonyl)-1,4-oxazepan-7-ol CAS Name: (3S)-3-[(2S)-butan-2-yl]-4-(4-methylphenyl)sulfonyl-1,4-oxazepan-7-ol IUPAC Name: (3S)-3-[(2S)-butan-2-yl]-4-(4-methylphenyl)sulfonyl-1,4-oxazepan-7-ol Traditional Name: (3S)-3-[(1S)-1-methylpropyl]-4-tosyl-1,4-oxazepan-7-ol Formula: C16H25NO4S MolecularWeight: 327.439

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1COC(CCN1S(=O)(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

CC[C@H](C)[C@H]1COC(CCN1S(=O)(=O)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C16H25NO4S/c1-4-13(3)15-11-21-16(18)9-10-17(15)22(19,20)14-7-5-12(2)6-8-14/h5-8,13,15-16,18H,4,9-11H2,1-3H3/t13-,15+,16?/m0/s1