1-[(4-methoxy-3-nitro-phenyl)methyl]isoquinoline

Systemtic Name: 1-[(4-methoxy-3-nitro-phenyl)methyl]isoquinoline Openeye Name: 1-[(4-methoxy-3-nitro-phenyl)methyl]isoquinoline CAS Name: 1-[(4-methoxy-3-nitrophenyl)methyl]isoquinoline IUPAC Name: 1-[(4-methoxy-3-nitrophenyl)methyl]isoquinoline Traditional Name: 1-(4-methoxy-3-nitro-benzyl)isoquinoline Formula: C17H14N2O3 MolecularWeight: 294.30466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC=CC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC=CC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O3/c1-22-17-7-6-12(11-16(17)19(20)21)10-15-14-5-3-2-4-13(14)8-9-18-15/h2-9,11H,10H2,1H3