7-methoxy-4-nitro-2-phenethyl-3H-isoindol-1-one

Systemtic Name: 7-methoxy-4-nitro-2-phenethyl-3H-isoindol-1-one Openeye Name: 7-methoxy-4-nitro-2-phenethyl-isoindolin-1-one CAS Name: 7-methoxy-4-nitro-2-phenethyl-3H-isoindol-1-one IUPAC Name: 7-methoxy-4-nitro-2-phenethyl-3H-isoindol-1-one Traditional Name: 7-methoxy-4-nitro-2-phenethyl-isoindolin-1-one Formula: C17H16N2O4 MolecularWeight: 312.31994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)[N+](=O)[O-])CN(C2=O)CCC3=CC=CC=C3

Isomeric SMILES

COC1=C2C(=C(C=C1)[N+](=O)[O-])CN(C2=O)CCC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O4/c1-23-15-8-7-14(19(21)22)13-11-18(17(20)16(13)15)10-9-12-5-3-2-4-6-12/h2-8H,9-11H2,1H3