6-chloranyl-3-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-chloranyl-3-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,3-benzoxazol-2-one Openeye Name: 6-chloro-3-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,3-benzoxazol-2-one CAS Name: 6-chloro-3-[[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-chloro-3-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,3-benzoxazol-2-one Traditional Name: 6-chloro-3-[(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinolin-1-yl)methyl]-1,3-benzoxazol-2-one Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)CN4C5=C(C=C(C=C5)Cl)OC4=O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)CN4C5=C(C=C(C=C5)Cl)OC4=O

InChI

InChI=1S/C21H22ClN3O4S/c22-16-5-7-19-20(13-16)29-21(26)25(19)14-23-9-3-4-15-12-17(6-8-18(15)23)30(27,28)24-10-1-2-11-24/h5-8,12-13H,1-4,9-11,14H2