3-[3-(azepan-1-yl)propyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[3-(azepan-1-yl)propyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[3-(azepan-1-yl)propyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-[3-(1-azepanyl)propyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-[3-(azepan-1-yl)propyl]-7-methoxy-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-[3-(azepan-1-yl)propyl]-7-methoxy-5H-pyrimid[5,4-b]indol-4-one Formula: C20H26N4O2 MolecularWeight: 354.44604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C=N3)CCCN4CCCCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C=N3)CCCN4CCCCCC4

InChI

InChI=1S/C20H26N4O2/c1-26-15-7-8-16-17(13-15)22-19-18(16)21-14-24(20(19)25)12-6-11-23-9-4-2-3-5-10-23/h7-8,13-14,22H,2-6,9-12H2,1H3