1-[5-(2-fluorophenyl)-1,3,3-trimethyl-2-oxidanylidene-1,4-benzodiazepin-7-yl]ethyl ethanoate

Systemtic Name: 1-[5-(2-fluorophenyl)-1,3,3-trimethyl-2-oxidanylidene-1,4-benzodiazepin-7-yl]ethyl ethanoate Openeye Name: 1-[5-(2-fluorophenyl)-1,3,3-trimethyl-2-oxo-1,4-benzodiazepin-7-yl]ethyl acetate CAS Name: acetic acid 1-[5-(2-fluorophenyl)-1,3,3-trimethyl-2-oxo-1,4-benzodiazepin-7-yl]ethyl ester IUPAC Name: 1-[5-(2-fluorophenyl)-1,3,3-trimethyl-2-oxo-1,4-benzodiazepin-7-yl]ethyl acetate Traditional Name: acetic acid 1-[5-(2-fluorophenyl)-2-keto-1,3,3-trimethyl-1,4-benzodiazepin-7-yl]ethyl ester Formula: C22H23FN2O3 MolecularWeight: 382.428023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)N(C(=O)C(N=C2C3=CC=CC=C3F)(C)C)C)OC(=O)C

Isomeric SMILES

CC(C1=CC2=C(C=C1)N(C(=O)C(N=C2C3=CC=CC=C3F)(C)C)C)OC(=O)C

InChI

InChI=1S/C22H23FN2O3/c1-13(28-14(2)26)15-10-11-19-17(12-15)20(16-8-6-7-9-18(16)23)24-22(3,4)21(27)25(19)5/h6-13H,1-5H3