4-butyl-6,6-bis(4-methylphenyl)isochromeno[3,4-d]pyrimidine-1,3-dione

Systemtic Name: 4-butyl-6,6-bis(4-methylphenyl)isochromeno[3,4-d]pyrimidine-1,3-dione Openeye Name: 4-butyl-6,6-bis(p-tolyl)isochromeno[3,4-d]pyrimidine-1,3-dione CAS Name: 4-butyl-6,6-bis(4-methylphenyl)[2]benzopyrano[3,4-d]pyrimidine-1,3-dione IUPAC Name: 4-butyl-6,6-bis(4-methylphenyl)isochromeno[3,4-d]pyrimidine-1,3-dione Traditional Name: 4-butyl-6,6-bis(p-tolyl)isochromeno[3,4-d]pyrimidine-1,3-quinone Formula: C29H28N2O3 MolecularWeight: 452.54422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C3=CC=CC=C3C(O2)(C4=CC=C(C=C4)C)C5=CC=C(C=C5)C)C(=O)NC1=O

Isomeric SMILES

CCCCN1C2=C(C3=CC=CC=C3C(O2)(C4=CC=C(C=C4)C)C5=CC=C(C=C5)C)C(=O)NC1=O

InChI

InChI=1S/C29H28N2O3/c1-4-5-18-31-27-25(26(32)30-28(31)33)23-8-6-7-9-24(23)29(34-27,21-14-10-19(2)11-15-21)22-16-12-20(3)13-17-22/h6-17H,4-5,18H2,1-3H3,(H,30,32,33)