1-(4-nitrophenyl)-2-propan-2-yl-3,4-dihydro-1H-isoquinoline-4,6,8-triol

Systemtic Name: 1-(4-nitrophenyl)-2-propan-2-yl-3,4-dihydro-1H-isoquinoline-4,6,8-triol Openeye Name: 2-isopropyl-1-(4-nitrophenyl)-3,4-dihydro-1H-isoquinoline-4,6,8-triol CAS Name: 1-(4-nitrophenyl)-2-propan-2-yl-3,4-dihydro-1H-isoquinoline-4,6,8-triol IUPAC Name: 1-(4-nitrophenyl)-2-propan-2-yl-3,4-dihydro-1H-isoquinoline-4,6,8-triol Traditional Name: 2-isopropyl-1-(4-nitrophenyl)-3,4-dihydro-1H-isoquinoline-4,6,8-triol Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(C2=CC(=CC(=C2C1C3=CC=C(C=C3)[N+](=O)[O-])O)O)O

Isomeric SMILES

CC(C)N1CC(C2=CC(=CC(=C2C1C3=CC=C(C=C3)[N+](=O)[O-])O)O)O

InChI

InChI=1S/C18H20N2O5/c1-10(2)19-9-16(23)14-7-13(21)8-15(22)17(14)18(19)11-3-5-12(6-4-11)20(24)25/h3-8,10,16,18,21-23H,9H2,1-2H3