3-[8-(2-fluorophenyl)-7-methoxy-2-oxidanylidene-1,3-dihydro-1,5-benzodiazepin-4-yl]benzenecarbonitrile

Systemtic Name: 3-[8-(2-fluorophenyl)-7-methoxy-2-oxidanylidene-1,3-dihydro-1,5-benzodiazepin-4-yl]benzenecarbonitrile Openeye Name: 3-[8-(2-fluorophenyl)-7-methoxy-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl]benzonitrile CAS Name: 3-[8-(2-fluorophenyl)-7-methoxy-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl]benzonitrile IUPAC Name: 3-[8-(2-fluorophenyl)-7-methoxy-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl]benzonitrile Traditional Name: 3-[8-(2-fluorophenyl)-2-keto-7-methoxy-1,3-dihydro-1,5-benzodiazepin-4-yl]benzonitrile Formula: C23H16FN3O2 MolecularWeight: 385.390443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1C3=CC=CC=C3F)NC(=O)CC(=N2)C4=CC=CC(=C4)C#N

Isomeric SMILES

COC1=CC2=C(C=C1C3=CC=CC=C3F)NC(=O)CC(=N2)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H16FN3O2/c1-29-22-11-21-20(10-17(22)16-7-2-3-8-18(16)24)27-23(28)12-19(26-21)15-6-4-5-14(9-15)13-25/h2-11H,12H2,1H3,(H,27,28)