4-(azidomethyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 4-(azidomethyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Openeye Name: 4-(azidomethyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid CAS Name: 4-(azidomethyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid IUPAC Name: 4-(azidomethyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Traditional Name: 4-(azidomethyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid Formula: C12H14N4O3 MolecularWeight: 262.26456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CN(CC2CN=[N+]=[N-])C(=O)O)C=C1

Isomeric SMILES

COC1=CC2=C(CN(CC2CN=[N+]=[N-])C(=O)O)C=C1

InChI

InChI=1S/C12H14N4O3/c1-19-10-3-2-8-6-16(12(17)18)7-9(5-14-15-13)11(8)4-10/h2-4,9H,5-7H2,1H3,(H,17,18)