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

Systemtic Name: 6-phenethyl-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 1-allyl-6-phenethyl-4-(3-phenoxyphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 6-phenethyl-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 6-phenethyl-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 1-allyl-6-phenethyl-4-(3-phenoxyphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C29H27N3O3 MolecularWeight: 465.54298

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C(NC1=O)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)N(C2)CCC5=CC=CC=C5

Isomeric SMILES

C=CCN1C2=C(C(NC1=O)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)N(C2)CCC5=CC=CC=C5

InChI

InChI=1S/C29H27N3O3/c1-2-17-32-25-20-31(18-16-21-10-5-3-6-11-21)28(33)26(25)27(30-29(32)34)22-12-9-15-24(19-22)35-23-13-7-4-8-14-23/h2-15,19,27H,1,16-18,20H2,(H,30,34)