2-(3-bromanyl-5-methyl-2-oxidanyl-phenyl)-3-[(3-nitrophenyl)methyl]-1H-indole-5-carboximidamide

Systemtic Name: 2-(3-bromanyl-5-methyl-2-oxidanyl-phenyl)-3-[(3-nitrophenyl)methyl]-1H-indole-5-carboximidamide Openeye Name: 2-(3-bromo-2-hydroxy-5-methyl-phenyl)-3-[(3-nitrophenyl)methyl]-1H-indole-5-carboxamidine CAS Name: 2-(3-bromo-2-hydroxy-5-methylphenyl)-3-[(3-nitrophenyl)methyl]-1H-indole-5-carboximidamide IUPAC Name: 2-(3-bromo-2-hydroxy-5-methylphenyl)-3-[(3-nitrophenyl)methyl]-1H-indole-5-carboximidamide Traditional Name: 2-(3-bromo-2-hydroxy-5-methyl-phenyl)-3-(3-nitrobenzyl)-1H-indole-5-carboxamidine Formula: C23H19BrN4O3 MolecularWeight: 479.32596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=N)N)CC4=CC(=CC=C4)[N+](=O)[O-])O)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=N)N)CC4=CC(=CC=C4)[N+](=O)[O-])O)Br

InChI

InChI=1S/C23H19BrN4O3/c1-12-7-18(22(29)19(24)8-12)21-17(10-13-3-2-4-15(9-13)28(30)31)16-11-14(23(25)26)5-6-20(16)27-21/h2-9,11,27,29H,10H2,1H3,(H3,25,26)