2-(3-bromanyl-5-methyl-2-oxidanyl-phenyl)-3-phenethyl-1H-indole-5-carboximidamide

Systemtic Name: 2-(3-bromanyl-5-methyl-2-oxidanyl-phenyl)-3-phenethyl-1H-indole-5-carboximidamide Openeye Name: 2-(3-bromo-2-hydroxy-5-methyl-phenyl)-3-phenethyl-1H-indole-5-carboxamidine CAS Name: 2-(3-bromo-2-hydroxy-5-methylphenyl)-3-phenethyl-1H-indole-5-carboximidamide IUPAC Name: 2-(3-bromo-2-hydroxy-5-methylphenyl)-3-phenethyl-1H-indole-5-carboximidamide Traditional Name: 2-(3-bromo-2-hydroxy-5-methyl-phenyl)-3-phenethyl-1H-indole-5-carboxamidine Formula: C24H22BrN3O MolecularWeight: 448.35498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=N)N)CCC4=CC=CC=C4)O)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=N)N)CCC4=CC=CC=C4)O)Br

InChI

InChI=1S/C24H22BrN3O/c1-14-11-19(23(29)20(25)12-14)22-17(9-7-15-5-3-2-4-6-15)18-13-16(24(26)27)8-10-21(18)28-22/h2-6,8,10-13,28-29H,7,9H2,1H3,(H3,26,27)