5-methoxy-1,3-dimethyl-2-(1,2,3-trideuteriopropyl)indole-4,7-dione

Systemtic Name: 5-methoxy-1,3-dimethyl-2-(1,2,3-trideuteriopropyl)indole-4,7-dione Openeye Name: 5-methoxy-1,3-dimethyl-2-(1,2,3-trideuteriopropyl)indole-4,7-dione CAS Name: 5-methoxy-1,3-dimethyl-2-(1,2,3-trideuteriopropyl)indole-4,7-dione IUPAC Name: 5-methoxy-1,3-dimethyl-2-(1,2,3-trideuteriopropyl)indole-4,7-dione Traditional Name: 5-methoxy-1,3-dimethyl-2-(1,2,3-trideuteriopropyl)indole-4,7-quinone Formula: C14H17NO3 MolecularWeight: 250.308165

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1C)C(=O)C=C(C2=O)OC)C

Isomeric SMILES

[2H]CC([2H])C([2H])C1=C(C2=C(N1C)C(=O)C=C(C2=O)OC)C

InChI

InChI=1S/C14H17NO3/c1-5-6-9-8(2)12-13(15(9)3)10(16)7-11(18-4)14(12)17/h7H,5-6H2,1-4H3/i1D,5D,6D