6-[[4-[(2-bromanyl-5-ethoxy-phenyl)methyl]piperidin-1-yl]methyl]-1-methyl-3-phenyl-pyrimidine-2,4-dione

Systemtic Name: 6-[[4-[(2-bromanyl-5-ethoxy-phenyl)methyl]piperidin-1-yl]methyl]-1-methyl-3-phenyl-pyrimidine-2,4-dione Openeye Name: 6-[[4-[(2-bromo-5-ethoxy-phenyl)methyl]-1-piperidyl]methyl]-1-methyl-3-phenyl-pyrimidine-2,4-dione CAS Name: 6-[[4-[(2-bromo-5-ethoxyphenyl)methyl]-1-piperidinyl]methyl]-1-methyl-3-phenylpyrimidine-2,4-dione IUPAC Name: 6-[[4-[(2-bromo-5-ethoxyphenyl)methyl]piperidin-1-yl]methyl]-1-methyl-3-phenylpyrimidine-2,4-dione Traditional Name: 6-[[4-(2-bromo-5-ethoxy-benzyl)piperidino]methyl]-1-methyl-3-phenyl-pyrimidine-2,4-quinone Formula: C26H30BrN3O3 MolecularWeight: 512.4387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3=CC(=O)N(C(=O)N3C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=C(C=C1)Br)CC2CCN(CC2)CC3=CC(=O)N(C(=O)N3C)C4=CC=CC=C4

InChI

InChI=1S/C26H30BrN3O3/c1-3-33-23-9-10-24(27)20(16-23)15-19-11-13-29(14-12-19)18-22-17-25(31)30(26(32)28(22)2)21-7-5-4-6-8-21/h4-10,16-17,19H,3,11-15,18H2,1-2H3