6-[2-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]ethylsulfinyl]-3H-1,3-benzoxazol-2-one

Systemtic Name: 6-[2-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]ethylsulfinyl]-3H-1,3-benzoxazol-2-one Openeye Name: 6-[2-[4-[(4-chlorophenyl)methyl]-1-piperidyl]ethylsulfinyl]-3H-1,3-benzoxazol-2-one CAS Name: 6-[2-[4-[(4-chlorophenyl)methyl]-1-piperidinyl]ethylsulfinyl]-3H-1,3-benzoxazol-2-one IUPAC Name: 6-[2-[4-[(4-chlorophenyl)methyl]piperidin-1-yl]ethylsulfinyl]-3H-1,3-benzoxazol-2-one Traditional Name: 6-[2-[4-(4-chlorobenzyl)piperidino]ethylsulfinyl]-3H-1,3-benzoxazol-2-one Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=C(C=C2)Cl)CCS(=O)C3=CC4=C(C=C3)NC(=O)O4

Isomeric SMILES

C1CN(CCC1CC2=CC=C(C=C2)Cl)CCS(=O)C3=CC4=C(C=C3)NC(=O)O4

InChI

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