6-chloranyl-5-[(1S)-1-oxidanyl-1-(4-oxidanyl-4-phenyl-piperidin-1-yl)propyl]-3H-1,3-benzoxazol-2-one

Systemtic Name: 6-chloranyl-5-[(1S)-1-oxidanyl-1-(4-oxidanyl-4-phenyl-piperidin-1-yl)propyl]-3H-1,3-benzoxazol-2-one Openeye Name: 6-chloro-5-[(1S)-1-hydroxy-1-(4-hydroxy-4-phenyl-1-piperidyl)propyl]-3H-1,3-benzoxazol-2-one CAS Name: 6-chloro-5-[(1S)-1-hydroxy-1-(4-hydroxy-4-phenyl-1-piperidinyl)propyl]-3H-1,3-benzoxazol-2-one IUPAC Name: 6-chloro-5-[(1S)-1-hydroxy-1-(4-hydroxy-4-phenylpiperidin-1-yl)propyl]-3H-1,3-benzoxazol-2-one Traditional Name: 6-chloro-5-[(1S)-1-hydroxy-1-(4-hydroxy-4-phenyl-piperidino)propyl]-3H-1,3-benzoxazol-2-one Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1Cl)OC(=O)N2)(N3CCC(CC3)(C4=CC=CC=C4)O)O

Isomeric SMILES

CC[C@](C1=CC2=C(C=C1Cl)OC(=O)N2)(N3CCC(CC3)(C4=CC=CC=C4)O)O

InChI

InChI=1S/C21H23ClN2O4/c1-2-21(27,15-12-17-18(13-16(15)22)28-19(25)23-17)24-10-8-20(26,9-11-24)14-6-4-3-5-7-14/h3-7,12-13,26-27H,2,8-11H2,1H3,(H,23,25)/t21-/m0/s1