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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-N-oxidanyl-benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-benzenecarbohydroxamic acid CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-hydroxy-3-nitrobenzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-hydroxy-3-nitrobenzamide Traditional Name: 2-(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=CC=C3[N+](=O)[O-])C(=O)NO

Isomeric SMILES

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

InChI

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