1-[(5-bromanyl-4-methoxy-2-nitro-phenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol

Systemtic Name: 1-[(5-bromanyl-4-methoxy-2-nitro-phenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol Openeye Name: 1-[(5-bromo-4-methoxy-2-nitro-phenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol CAS Name: 1-[(5-bromo-4-methoxy-2-nitrophenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol IUPAC Name: 1-[(5-bromo-4-methoxy-2-nitrophenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol Traditional Name: 1-(5-bromo-4-methoxy-2-nitro-benzyl)-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol Formula: C19H21BrN2O5 MolecularWeight: 437.28444

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3[N+](=O)[O-])OC)Br)O)OC

Isomeric SMILES

CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3[N+](=O)[O-])OC)Br)O)OC

InChI

InChI=1S/C19H21BrN2O5/c1-21-5-4-11-8-19(27-3)17(23)9-13(11)16(21)7-12-6-14(20)18(26-2)10-15(12)22(24)25/h6,8-10,16,23H,4-5,7H2,1-3H3