7-(3-chloranyl-4-fluoranyl-phenyl)-4,5,5-trimethyl-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7-(3-chloranyl-4-fluoranyl-phenyl)-4,5,5-trimethyl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-(3-chloro-4-fluoro-phenyl)-4,5,5-trimethyl-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-(3-chloro-4-fluorophenyl)-4,5,5-trimethyl-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-(3-chloro-4-fluorophenyl)-4,5,5-trimethyl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-(3-chloro-4-fluoro-phenyl)-4,5,5-trimethyl-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C18H18ClFN2O MolecularWeight: 332.799723

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=C(C=C3)F)Cl)NC(=O)CN1C)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=C(C=C3)F)Cl)NC(=O)CN1C)C

InChI

InChI=1S/C18H18ClFN2O/c1-18(2)13-8-11(12-4-6-15(20)14(19)9-12)5-7-16(13)21-17(23)10-22(18)3/h4-9H,10H2,1-3H3,(H,21,23)