5-isoquinolin-5-ylsulfonyl-2-nitro-phenol

Systemtic Name: 5-isoquinolin-5-ylsulfonyl-2-nitro-phenol Openeye Name: 5-(5-isoquinolylsulfonyl)-2-nitro-phenol CAS Name: 5-(5-isoquinolinylsulfonyl)-2-nitrophenol IUPAC Name: 5-isoquinolin-5-ylsulfonyl-2-nitrophenol Traditional Name: 5-(5-isoquinolylsulfonyl)-2-nitro-phenol Formula: C15H10N2O5S MolecularWeight: 330.3153

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10N2O5S/c18-14-8-11(4-5-13(14)17(19)20)23(21,22)15-3-1-2-10-9-16-7-6-12(10)15/h1-9,18H