9-methoxy-5H-pyrimido[5,4-b]indole-2-carboxylic acid

Systemtic Name: 9-methoxy-5H-pyrimido[5,4-b]indole-2-carboxylic acid Openeye Name: 9-methoxy-5H-pyrimido[5,4-b]indole-2-carboxylic acid CAS Name: 9-methoxy-5H-pyrimido[5,4-b]indole-2-carboxylic acid IUPAC Name: 9-methoxy-5H-pyrimido[5,4-b]indole-2-carboxylic acid Traditional Name: 9-methoxy-5H-pyrimid[5,4-b]indole-2-carboxylic acid Formula: C12H9N3O3 MolecularWeight: 243.21816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C3=NC(=NC=C3N2)C(=O)O

Isomeric SMILES

COC1=CC=CC2=C1C3=NC(=NC=C3N2)C(=O)O

InChI

InChI=1S/C12H9N3O3/c1-18-8-4-2-3-6-9(8)10-7(14-6)5-13-11(15-10)12(16)17/h2-5,14H,1H3,(H,16,17)