3-azanyl-5-(2-fluorophenyl)-9-methyl-1-(2-oxidanylidenepropyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-5-(2-fluorophenyl)-9-methyl-1-(2-oxidanylidenepropyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 1-acetonyl-3-amino-5-(2-fluorophenyl)-9-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-5-(2-fluorophenyl)-9-methyl-1-(2-oxopropyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-5-(2-fluorophenyl)-9-methyl-1-(2-oxopropyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 1-acetonyl-3-amino-5-(2-fluorophenyl)-9-methyl-3H-1,4-benzodiazepin-2-one Formula: C19H18FN3O2 MolecularWeight: 339.363523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)C(N=C2C3=CC=CC=C3F)N)CC(=O)C

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)C(N=C2C3=CC=CC=C3F)N)CC(=O)C

InChI

InChI=1S/C19H18FN3O2/c1-11-6-5-8-14-16(13-7-3-4-9-15(13)20)22-18(21)19(25)23(17(11)14)10-12(2)24/h3-9,18H,10,21H2,1-2H3