(3S)-4-(4-methylphenyl)sulfonyl-3-phenyl-1,4-oxazepan-7-ol

Systemtic Name: (3S)-4-(4-methylphenyl)sulfonyl-3-phenyl-1,4-oxazepan-7-ol Openeye Name: (3S)-3-phenyl-4-(p-tolylsulfonyl)-1,4-oxazepan-7-ol CAS Name: (3S)-4-(4-methylphenyl)sulfonyl-3-phenyl-1,4-oxazepan-7-ol IUPAC Name: (3S)-4-(4-methylphenyl)sulfonyl-3-phenyl-1,4-oxazepan-7-ol Traditional Name: (3S)-3-phenyl-4-tosyl-1,4-oxazepan-7-ol Formula: C18H21NO4S MolecularWeight: 347.42864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(OCC2C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(OC[C@@H]2C3=CC=CC=C3)O

InChI

InChI=1S/C18H21NO4S/c1-14-7-9-16(10-8-14)24(21,22)19-12-11-18(20)23-13-17(19)15-5-3-2-4-6-15/h2-10,17-18,20H,11-13H2,1H3/t17-,18?/m1/s1