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

Systemtic Name: 6-(3-methoxypropyl)-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 1-allyl-6-(3-methoxypropyl)-4-(3-phenoxyphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 6-(3-methoxypropyl)-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 6-(3-methoxypropyl)-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 1-allyl-6-(3-methoxypropyl)-4-(3-phenoxyphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1CC2=C(C1=O)C(NC(=O)N2CC=C)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

COCCCN1CC2=C(C1=O)C(NC(=O)N2CC=C)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O4/c1-3-13-28-21-17-27(14-8-15-31-2)24(29)22(21)23(26-25(28)30)18-9-7-12-20(16-18)32-19-10-5-4-6-11-19/h3-7,9-12,16,23H,1,8,13-15,17H2,2H3,(H,26,30)