2-[(5-nitrofuran-2-yl)methyl]isoquinolin-1-one

Systemtic Name: 2-[(5-nitrofuran-2-yl)methyl]isoquinolin-1-one Openeye Name: 2-[(5-nitro-2-furyl)methyl]isoquinolin-1-one CAS Name: 2-[(5-nitro-2-furanyl)methyl]-1-isoquinolinone IUPAC Name: 2-[(5-nitrofuran-2-yl)methyl]isoquinolin-1-one Traditional Name: 2-[(5-nitro-2-furyl)methyl]isocarbostyril Formula: C14H10N2O4 MolecularWeight: 270.2402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN(C2=O)CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CN(C2=O)CC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O4/c17-14-12-4-2-1-3-10(12)7-8-15(14)9-11-5-6-13(20-11)16(18)19/h1-8H,9H2