3-[2-(3,4-dimethoxyphenyl)ethyl]-5,8-dimethyl-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5,8-dimethyl-pyrimido[5,4-b]indol-4-one Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5,8-dimethyl-pyrimido[5,4-b]indol-4-one CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5,8-dimethyl-4-pyrimido[5,4-b]indolone IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-5,8-dimethylpyrimido[5,4-b]indol-4-one Traditional Name: 3-homoveratryl-5,8-dimethyl-pyrimid[5,4-b]indol-4-one Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2N=CN(C3=O)CCC4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2N=CN(C3=O)CCC4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C22H23N3O3/c1-14-5-7-17-16(11-14)20-21(24(17)2)22(26)25(13-23-20)10-9-15-6-8-18(27-3)19(12-15)28-4/h5-8,11-13H,9-10H2,1-4H3