N-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (7,8-dimethoxy-5H-pyrimid[5,4-b]indol-4-yl)-homoveratryl-amine Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2NC4=CC(=C(C=C43)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NC=NC3=C2NC4=CC(=C(C=C43)OC)OC)OC

InChI

InChI=1S/C22H24N4O4/c1-27-16-6-5-13(9-17(16)28-2)7-8-23-22-21-20(24-12-25-22)14-10-18(29-3)19(30-4)11-15(14)26-21/h5-6,9-12,26H,7-8H2,1-4H3,(H,23,24,25)