6-[(4-hexylphenyl)amino]-1-(3-oxidanylpropyl)pyrimidine-2,4-dione

Systemtic Name: 6-[(4-hexylphenyl)amino]-1-(3-oxidanylpropyl)pyrimidine-2,4-dione Openeye Name: 6-(4-hexylanilino)-1-(3-hydroxypropyl)pyrimidine-2,4-dione CAS Name: 6-(4-hexylanilino)-1-(3-hydroxypropyl)pyrimidine-2,4-dione IUPAC Name: 6-(4-hexylanilino)-1-(3-hydroxypropyl)pyrimidine-2,4-dione Traditional Name: 6-(4-hexylanilino)-1-(3-hydroxypropyl)pyrimidine-2,4-quinone Formula: C19H27N3O3 MolecularWeight: 345.43598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)NC2=CC(=O)NC(=O)N2CCCO

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)NC2=CC(=O)NC(=O)N2CCCO

InChI

InChI=1S/C19H27N3O3/c1-2-3-4-5-7-15-8-10-16(11-9-15)20-17-14-18(24)21-19(25)22(17)12-6-13-23/h8-11,14,20,23H,2-7,12-13H2,1H3,(H,21,24,25)