3,4-dihydro-1H-isoquinolin-2-yl-(5-nitrofuran-2-yl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(5-nitrofuran-2-yl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(5-nitro-2-furyl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(5-nitro-2-furanyl)methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(5-nitrofuran-2-yl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(5-nitro-2-furyl)methanone Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O4/c17-14(12-5-6-13(20-12)16(18)19)15-8-7-10-3-1-2-4-11(10)9-15/h1-6H,7-9H2