7-methoxy-4-[(3-nitrophenyl)methyl]-2H-isoquinolin-8-one

Systemtic Name: 7-methoxy-4-[(3-nitrophenyl)methyl]-2H-isoquinolin-8-one Openeye Name: 7-methoxy-4-[(3-nitrophenyl)methyl]-2H-isoquinolin-8-one CAS Name: 7-methoxy-4-[(3-nitrophenyl)methyl]-2H-isoquinolin-8-one IUPAC Name: 7-methoxy-4-[(3-nitrophenyl)methyl]-2H-isoquinolin-8-one Traditional Name: 7-methoxy-4-(3-nitrobenzyl)-2H-isoquinolin-8-one Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C2C(=CNC=C2C1=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C2C(=CNC=C2C1=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O4/c1-23-16-6-5-14-12(9-18-10-15(14)17(16)20)7-11-3-2-4-13(8-11)19(21)22/h2-6,8-10,18H,7H2,1H3