5-chloranyl-3-[2-[4-(phenylmethyl)piperidin-1-yl]ethylsulfinyl]-1,3-benzoxazol-2-one

Systemtic Name: 5-chloranyl-3-[2-[4-(phenylmethyl)piperidin-1-yl]ethylsulfinyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-(4-benzyl-1-piperidyl)ethylsulfinyl]-5-chloro-1,3-benzoxazol-2-one CAS Name: 5-chloro-3-[2-[4-(phenylmethyl)-1-piperidinyl]ethylsulfinyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)ethylsulfinyl]-5-chloro-1,3-benzoxazol-2-one Traditional Name: 3-[2-(4-benzylpiperidino)ethylsulfinyl]-5-chloro-1,3-benzoxazol-2-one Formula: C21H23ClN2O3S MolecularWeight: 418.93692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCS(=O)N3C4=C(C=CC(=C4)Cl)OC3=O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCS(=O)N3C4=C(C=CC(=C4)Cl)OC3=O

InChI

InChI=1S/C21H23ClN2O3S/c22-18-6-7-20-19(15-18)24(21(25)27-20)28(26)13-12-23-10-8-17(9-11-23)14-16-4-2-1-3-5-16/h1-7,15,17H,8-14H2