1-(1,4-diazepan-1-yl)-7-methoxy-isoquinoline

Systemtic Name: 1-(1,4-diazepan-1-yl)-7-methoxy-isoquinoline Openeye Name: 1-(1,4-diazepan-1-yl)-7-methoxy-isoquinoline CAS Name: 1-(1,4-diazepan-1-yl)-7-methoxyisoquinoline IUPAC Name: 1-(1,4-diazepan-1-yl)-7-methoxyisoquinoline Traditional Name: 1-(1,4-diazepan-1-yl)-7-methoxy-isoquinoline Formula: C15H19N3O MolecularWeight: 257.33086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CN=C2N3CCCNCC3

Isomeric SMILES

COC1=CC2=C(C=C1)C=CN=C2N3CCCNCC3

InChI

InChI=1S/C15H19N3O/c1-19-13-4-3-12-5-7-17-15(14(12)11-13)18-9-2-6-16-8-10-18/h3-5,7,11,16H,2,6,8-10H2,1H3