6,7-dimethoxy-1-(2-nitrophenyl)spiro[3H-isoquinoline-4,1'-cyclopentane]

Systemtic Name: 6,7-dimethoxy-1-(2-nitrophenyl)spiro[3H-isoquinoline-4,1'-cyclopentane] Openeye Name: 6,7-dimethoxy-1-(2-nitrophenyl)spiro[3H-isoquinoline-4,1'-cyclopentane] CAS Name: 6,7-dimethoxy-1-(2-nitrophenyl)spiro[3H-isoquinoline-4,1'-cyclopentane] IUPAC Name: 6,7-dimethoxy-1-(2-nitrophenyl)spiro[3H-isoquinoline-4,1'-cyclopentane] Traditional Name: 6,7-dimethoxy-1-(2-nitrophenyl)spiro[3H-isoquinoline-4,1'-cyclopentane] Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NCC23CCCC3)C4=CC=CC=C4[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NCC23CCCC3)C4=CC=CC=C4[N+](=O)[O-])OC

InChI

InChI=1S/C21H22N2O4/c1-26-18-11-15-16(12-19(18)27-2)21(9-5-6-10-21)13-22-20(15)14-7-3-4-8-17(14)23(24)25/h3-4,7-8,11-12H,5-6,9-10,13H2,1-2H3