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

Systemtic Name: 5-chloranyl-6-[1-oxidanyl-3-[3-(phenylmethyl)piperidin-1-yl]propyl]-3H-1,3-benzoxazol-2-one Openeye Name: 6-[3-(3-benzyl-1-piperidyl)-1-hydroxy-propyl]-5-chloro-3H-1,3-benzoxazol-2-one CAS Name: 5-chloro-6-[1-hydroxy-3-[3-(phenylmethyl)-1-piperidinyl]propyl]-3H-1,3-benzoxazol-2-one IUPAC Name: 6-[3-(3-benzylpiperidin-1-yl)-1-hydroxypropyl]-5-chloro-3H-1,3-benzoxazol-2-one Traditional Name: 6-[3-(3-benzylpiperidino)-1-hydroxy-propyl]-5-chloro-3H-1,3-benzoxazol-2-one Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCC(C2=CC3=C(C=C2Cl)NC(=O)O3)O)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)CCC(C2=CC3=C(C=C2Cl)NC(=O)O3)O)CC4=CC=CC=C4

InChI

InChI=1S/C22H25ClN2O3/c23-18-13-19-21(28-22(27)24-19)12-17(18)20(26)8-10-25-9-4-7-16(14-25)11-15-5-2-1-3-6-15/h1-3,5-6,12-13,16,20,26H,4,7-11,14H2,(H,24,27)