6-butyl-4-(2,5-dimethoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione

Systemtic Name: 6-butyl-4-(2,5-dimethoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 1-allyl-6-butyl-4-(2,5-dimethoxyphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 6-butyl-4-(2,5-dimethoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 6-butyl-4-(2,5-dimethoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 1-allyl-6-butyl-4-(2,5-dimethoxyphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC2=C(C1=O)C(NC(=O)N2CC=C)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCCCN1CC2=C(C1=O)C(NC(=O)N2CC=C)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H27N3O4/c1-5-7-11-23-13-16-18(20(23)25)19(22-21(26)24(16)10-6-2)15-12-14(27-3)8-9-17(15)28-4/h6,8-9,12,19H,2,5,7,10-11,13H2,1,3-4H3,(H,22,26)