2-[(5-chloranyl-3-oxidanyl-1H-indol-2-yl)-phenyl-methyl]propanedinitrile

Systemtic Name: 2-[(5-chloranyl-3-oxidanyl-1H-indol-2-yl)-phenyl-methyl]propanedinitrile Openeye Name: 2-[(5-chloro-3-hydroxy-1H-indol-2-yl)-phenyl-methyl]propanedinitrile CAS Name: 2-[(5-chloro-3-hydroxy-1H-indol-2-yl)-phenylmethyl]propanedinitrile IUPAC Name: 2-[(5-chloro-3-hydroxy-1H-indol-2-yl)-phenylmethyl]propanedinitrile Traditional Name: 2-[(5-chloro-3-hydroxy-1H-indol-2-yl)-phenyl-methyl]malononitrile Formula: C18H12ClN3O MolecularWeight: 321.76038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(C3=C(N2)C=CC(=C3)Cl)O)C(C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=C(C3=C(N2)C=CC(=C3)Cl)O)C(C#N)C#N

InChI

InChI=1S/C18H12ClN3O/c19-13-6-7-15-14(8-13)18(23)17(22-15)16(12(9-20)10-21)11-4-2-1-3-5-11/h1-8,12,16,22-23H