2-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-3-(phenylmethyl)-1H-indole-5-carboximidamide

Systemtic Name: 2-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-3-(phenylmethyl)-1H-indole-5-carboximidamide Openeye Name: 3-benzyl-2-(3,5-dibromo-2-hydroxy-phenyl)-1H-indole-5-carboxamidine CAS Name: 2-(3,5-dibromo-2-hydroxyphenyl)-3-(phenylmethyl)-1H-indole-5-carboximidamide IUPAC Name: 3-benzyl-2-(3,5-dibromo-2-hydroxyphenyl)-1H-indole-5-carboximidamide Traditional Name: 3-benzyl-2-(3,5-dibromo-2-hydroxy-phenyl)-1H-indole-5-carboxamidine Formula: C22H17Br2N3O MolecularWeight: 499.19788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(NC3=C2C=C(C=C3)C(=N)N)C4=CC(=CC(=C4O)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(NC3=C2C=C(C=C3)C(=N)N)C4=CC(=CC(=C4O)Br)Br

InChI

InChI=1S/C22H17Br2N3O/c23-14-10-17(21(28)18(24)11-14)20-16(8-12-4-2-1-3-5-12)15-9-13(22(25)26)6-7-19(15)27-20/h1-7,9-11,27-28H,8H2,(H3,25,26)