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

Systemtic Name: 2-(7-chloranyl-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)ethanenitrile Openeye Name: 2-(7-chloro-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)acetonitrile CAS Name: 2-(7-chloro-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)acetonitrile IUPAC Name: 2-(7-chloro-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)acetonitrile Traditional Name: 2-(7-chloro-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)acetonitrile Formula: C18H16ClN3 MolecularWeight: 309.79274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3/c1-22-15(9-10-20)12-21-18(13-5-3-2-4-6-13)16-11-14(19)7-8-17(16)22/h2-8,11,15H,9,12H2,1H3