2-[7-chloranyl-5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]ethanenitrile

Systemtic Name: 2-[7-chloranyl-5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]ethanenitrile Openeye Name: 2-[7-chloro-5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]acetonitrile CAS Name: 2-[7-chloro-5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]acetonitrile IUPAC Name: 2-[7-chloro-5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]acetonitrile Traditional Name: 2-[7-chloro-5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]acetonitrile Formula: C18H15ClFN3 MolecularWeight: 327.783203

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F)CC#N

Isomeric SMILES

CN1C(CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F)CC#N

InChI

InChI=1S/C18H15ClFN3/c1-23-13(8-9-21)11-22-18(14-4-2-3-5-16(14)20)15-10-12(19)6-7-17(15)23/h2-7,10,13H,8,11H2,1H3