2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromanyl-2-methoxy-phenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxy-phenol

Systemtic Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromanyl-2-methoxy-phenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxy-phenol Openeye Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromo-2-methoxy-phenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxy-phenol CAS Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromo-2-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxyphenol IUPAC Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromo-2-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxyphenol Traditional Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromo-2-methoxy-phenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxy-phenol Formula: C26H25BrN2O5 MolecularWeight: 525.3911

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C2C=C(NC(N2)C3=C(C=CC(=C3)Br)OC)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC1=CC=CC(=C1O)C2C=C(NC(N2)C3=C(C=CC(=C3)Br)OC)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H25BrN2O5/c1-3-32-23-6-4-5-17(25(23)30)20-13-19(15-7-9-22-24(11-15)34-14-33-22)28-26(29-20)18-12-16(27)8-10-21(18)31-2/h4-13,20,26,28-30H,3,14H2,1-2H3