4-bromanyl-5-isoquinolin-5-ylsulfonyl-2-nitro-aniline

Systemtic Name: 4-bromanyl-5-isoquinolin-5-ylsulfonyl-2-nitro-aniline Openeye Name: 4-bromo-5-(5-isoquinolylsulfonyl)-2-nitro-aniline CAS Name: 4-bromo-5-(5-isoquinolinylsulfonyl)-2-nitroaniline IUPAC Name: 4-bromo-5-isoquinolin-5-ylsulfonyl-2-nitroaniline Traditional Name: [4-bromo-5-(5-isoquinolylsulfonyl)-2-nitro-phenyl]amine Formula: C15H10BrN3O4S MolecularWeight: 408.2266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)C3=C(C=C(C(=C3)N)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)C3=C(C=C(C(=C3)N)[N+](=O)[O-])Br

InChI

InChI=1S/C15H10BrN3O4S/c16-11-6-13(19(20)21)12(17)7-15(11)24(22,23)14-3-1-2-9-8-18-5-4-10(9)14/h1-8H,17H2