5-(4-fluorophenyl)-7-methyl-4-pentanoyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 5-(4-fluorophenyl)-7-methyl-4-pentanoyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 5-(4-fluorophenyl)-7-methyl-4-pentanoyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 5-(4-fluorophenyl)-7-methyl-4-(1-oxopentyl)-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 5-(4-fluorophenyl)-7-methyl-4-pentanoyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 5-(4-fluorophenyl)-7-methyl-4-valeryl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C21H23FN2O2 MolecularWeight: 354.417923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CC(=O)NC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)C

Isomeric SMILES

CCCCC(=O)N1CC(=O)NC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)C

InChI

InChI=1S/C21H23FN2O2/c1-3-4-5-20(26)24-13-19(25)23-18-11-6-14(2)12-17(18)21(24)15-7-9-16(22)10-8-15/h6-12,21H,3-5,13H2,1-2H3,(H,23,25)