2-ethoxy-6-[6-(4-ethylphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol

Systemtic Name: 2-ethoxy-6-[6-(4-ethylphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Openeye Name: 2-ethoxy-6-[6-(4-ethylphenyl)-2-isopropyl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol CAS Name: 2-ethoxy-6-[6-(4-ethylphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol IUPAC Name: 2-ethoxy-6-[6-(4-ethylphenyl)-2-propan-2-yl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Traditional Name: 2-ethoxy-6-[6-(4-ethylphenyl)-2-isopropyl-1,2,3,4-tetrahydropyrimidin-3-ium-4-yl]phenol Formula: C23H31N2O2+ MolecularWeight: 367.50444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC([NH2+]C(N2)C(C)C)C3=C(C(=CC=C3)OCC)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC([NH2+]C(N2)C(C)C)C3=C(C(=CC=C3)OCC)O

InChI

InChI=1S/C23H30N2O2/c1-5-16-10-12-17(13-11-16)19-14-20(25-23(24-19)15(3)4)18-8-7-9-21(22(18)26)27-6-2/h7-15,20,23-26H,5-6H2,1-4H3/p+1