3-(3-fluorophenyl)-7-methyl-5-(4-pyrrolidin-1-ylbutyl)-6,7-dihydro-5H-1,2-benzoxazol-4-one

Systemtic Name: 3-(3-fluorophenyl)-7-methyl-5-(4-pyrrolidin-1-ylbutyl)-6,7-dihydro-5H-1,2-benzoxazol-4-one Openeye Name: 3-(3-fluorophenyl)-7-methyl-5-(4-pyrrolidin-1-ylbutyl)-6,7-dihydro-5H-1,2-benzoxazol-4-one CAS Name: 3-(3-fluorophenyl)-7-methyl-5-[4-(1-pyrrolidinyl)butyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one IUPAC Name: 3-(3-fluorophenyl)-7-methyl-5-(4-pyrrolidin-1-ylbutyl)-6,7-dihydro-5H-1,2-benzoxazol-4-one Traditional Name: 3-(3-fluorophenyl)-7-methyl-5-(4-pyrrolidinobutyl)-6,7-dihydro-5H-indoxazen-4-one Formula: C22H27FN2O2 MolecularWeight: 370.460383

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)C2=C1ON=C2C3=CC(=CC=C3)F)CCCCN4CCCC4

Isomeric SMILES

CC1CC(C(=O)C2=C1ON=C2C3=CC(=CC=C3)F)CCCCN4CCCC4

InChI

InChI=1S/C22H27FN2O2/c1-15-13-17(7-2-3-10-25-11-4-5-12-25)21(26)19-20(24-27-22(15)19)16-8-6-9-18(23)14-16/h6,8-9,14-15,17H,2-5,7,10-13H2,1H3