(2Z)-2-(7-chloranyl-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)ethanenitrile

Systemtic Name: (2Z)-2-(7-chloranyl-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)ethanenitrile Openeye Name: (2Z)-2-(7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)acetonitrile CAS Name: (2Z)-2-(7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)acetonitrile IUPAC Name: (2Z)-2-(7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)acetonitrile Traditional Name: (2Z)-2-(7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)acetonitrile Formula: C18H14ClN3 MolecularWeight: 307.77686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN1/C(=C\C#N)/CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H14ClN3/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/h2-9,11H,12H2,1H3/b15-9-