(3-azanyl-7-nitro-isoquinolin-4-yl)-pyrrolidin-1-yl-methanone

Systemtic Name: (3-azanyl-7-nitro-isoquinolin-4-yl)-pyrrolidin-1-yl-methanone Openeye Name: (3-amino-7-nitro-4-isoquinolyl)-pyrrolidin-1-yl-methanone CAS Name: (3-amino-7-nitro-4-isoquinolinyl)-(1-pyrrolidinyl)methanone IUPAC Name: (3-amino-7-nitroisoquinolin-4-yl)-pyrrolidin-1-ylmethanone Traditional Name: (3-amino-7-nitro-4-isoquinolyl)-pyrrolidino-methanone Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C3C=CC(=CC3=CN=C2N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2=C3C=CC(=CC3=CN=C2N)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O3/c15-13-12(14(19)17-5-1-2-6-17)11-4-3-10(18(20)21)7-9(11)8-16-13/h3-4,7-8H,1-2,5-6H2,(H2,15,16)