5-(1,3-benzodioxol-5-yl)-1-phenethyl-pyrido[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-phenethyl-pyrido[2,3-d]pyrimidine-2,4-dione Openeye Name: 5-(1,3-benzodioxol-5-yl)-1-phenethyl-pyrido[2,3-d]pyrimidine-2,4-dione CAS Name: 5-(1,3-benzodioxol-5-yl)-1-phenethylpyrido[2,3-d]pyrimidine-2,4-dione IUPAC Name: 5-(1,3-benzodioxol-5-yl)-1-phenethylpyrido[2,3-d]pyrimidine-2,4-dione Traditional Name: 5-(1,3-benzodioxol-5-yl)-1-phenethyl-pyrido[2,3-d]pyrimidine-2,4-quinone Formula: C22H17N3O4 MolecularWeight: 387.38808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C4C(=O)NC(=O)N(C4=NC=C3)CCC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C4C(=O)NC(=O)N(C4=NC=C3)CCC5=CC=CC=C5

InChI

InChI=1S/C22H17N3O4/c26-21-19-16(15-6-7-17-18(12-15)29-13-28-17)8-10-23-20(19)25(22(27)24-21)11-9-14-4-2-1-3-5-14/h1-8,10,12H,9,11,13H2,(H,24,26,27)