2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-5-nitro-benzaldehyde

Systemtic Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-5-nitro-benzaldehyde Openeye Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-5-nitro-benzaldehyde CAS Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-5-nitrobenzaldehyde IUPAC Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-5-nitrobenzaldehyde Traditional Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-5-nitro-benzaldehyde Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(CCC2C1)C3=C(C=C(C=C3)[N+](=O)[O-])C=O

Isomeric SMILES

C1CCC2CN(CCC2C1)C3=C(C=C(C=C3)[N+](=O)[O-])C=O

InChI

InChI=1S/C16H20N2O3/c19-11-14-9-15(18(20)21)5-6-16(14)17-8-7-12-3-1-2-4-13(12)10-17/h5-6,9,11-13H,1-4,7-8,10H2