4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-N-oxidanyl-benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-N-oxidanyl-benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-benzenecarbohydroxamic acid CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-hydroxy-3-nitrobenzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-hydroxy-3-nitrobenzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-benzenecarbohydroxamic acid Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)C(=O)NO)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)C(=O)NO)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4/c20-16(17-21)12-5-6-14(15(9-12)19(22)23)18-8-7-11-3-1-2-4-13(11)10-18/h1-6,9,21H,7-8,10H2,(H,17,20)