1-azido-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]ethanone

Systemtic Name: 1-azido-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]ethanone Openeye Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]acetyl azide CAS Name: 1-azido-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitrophenyl]ethanone IUPAC Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitrophenyl]acetyl azide Traditional Name: 1-azido-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]ethanone Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N5O3/c18-20-19-17(23)10-14-9-15(22(24)25)5-6-16(14)21-8-7-12-3-1-2-4-13(12)11-21/h1-6,9H,7-8,10-11H2