2-(2,4-dimethyl-5-nitro-phenyl)-7-methoxy-4H-isoquinoline-1,3-dione

Systemtic Name: 2-(2,4-dimethyl-5-nitro-phenyl)-7-methoxy-4H-isoquinoline-1,3-dione Openeye Name: 2-(2,4-dimethyl-5-nitro-phenyl)-7-methoxy-4H-isoquinoline-1,3-dione CAS Name: 2-(2,4-dimethyl-5-nitrophenyl)-7-methoxy-4H-isoquinoline-1,3-dione IUPAC Name: 2-(2,4-dimethyl-5-nitrophenyl)-7-methoxy-4H-isoquinoline-1,3-dione Traditional Name: 2-(2,4-dimethyl-5-nitro-phenyl)-7-methoxy-4H-isoquinoline-1,3-quinone Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N2C(=O)CC3=C(C2=O)C=C(C=C3)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1N2C(=O)CC3=C(C2=O)C=C(C=C3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C18H16N2O5/c1-10-6-11(2)16(20(23)24)9-15(10)19-17(21)7-12-4-5-13(25-3)8-14(12)18(19)22/h4-6,8-9H,7H2,1-3H3