3-bromanyl-2-(6-chloranyl-9-ethanoyl-3H-phenanthro[9,10-d]imidazol-2-yl)benzenecarbonitrile

Systemtic Name: 3-bromanyl-2-(6-chloranyl-9-ethanoyl-3H-phenanthro[9,10-d]imidazol-2-yl)benzenecarbonitrile Openeye Name: 2-(9-acetyl-6-chloro-3H-phenanthro[9,10-d]imidazol-2-yl)-3-bromo-benzonitrile CAS Name: 2-(9-acetyl-6-chloro-3H-phenanthro[9,10-d]imidazol-2-yl)-3-bromobenzonitrile IUPAC Name: 2-(9-acetyl-6-chloro-3H-phenanthro[9,10-d]imidazol-2-yl)-3-bromobenzonitrile Traditional Name: 2-(9-acetyl-6-chloro-3H-phenanthr[9,10-d]imidazol-2-yl)-3-bromo-benzonitrile Formula: C24H13BrClN3O MolecularWeight: 474.73652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)C3=C(C4=C2C=C(C=C4)Cl)NC(=N3)C5=C(C=CC=C5Br)C#N

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)C3=C(C4=C2C=C(C=C4)Cl)NC(=N3)C5=C(C=CC=C5Br)C#N

InChI

InChI=1S/C24H13BrClN3O/c1-12(30)13-5-7-16-18(9-13)19-10-15(26)6-8-17(19)23-22(16)28-24(29-23)21-14(11-27)3-2-4-20(21)25/h2-10H,1H3,(H,28,29)