N-[(3,4-dimethoxyphenyl)methyl]-N-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: N-allyl-N-[(3,4-dimethoxyphenyl)methyl]-5H-pyrimido[5,4-b]indol-4-amine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: allyl-(5H-pyrimid[5,4-b]indol-4-yl)-veratryl-amine Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC=C)C2=NC=NC3=C2NC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC=C)C2=NC=NC3=C2NC4=CC=CC=C43)OC

InChI

InChI=1S/C22H22N4O2/c1-4-11-26(13-15-9-10-18(27-2)19(12-15)28-3)22-21-20(23-14-24-22)16-7-5-6-8-17(16)25-21/h4-10,12,14,25H,1,11,13H2,2-3H3