(2S)-2-(2-methoxynaphthalen-1-yl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-1-ium

Systemtic Name: (2S)-2-(2-methoxynaphthalen-1-yl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-1-ium Openeye Name: (2S)-2-(2-methoxy-1-naphthyl)-1,3-bis[(4-methoxyphenyl)methyl]hexahydropyrimidin-1-ium CAS Name: (2S)-2-(2-methoxy-1-naphthalenyl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-1-ium IUPAC Name: (2S)-2-(2-methoxynaphthalen-1-yl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinan-1-ium Traditional Name: (2S)-2-(2-methoxy-1-naphthyl)-1,3-bis(p-anisyl)hexahydropyrimidin-1-ium Formula: C31H35N2O3+ MolecularWeight: 483.6212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCCN(C2C3=C(C=CC4=CC=CC=C43)OC)CC5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCCN([C@@H]2C3=C(C=CC4=CC=CC=C43)OC)CC5=CC=C(C=C5)OC

InChI

InChI=1S/C31H34N2O3/c1-34-26-14-9-23(10-15-26)21-32-19-6-20-33(22-24-11-16-27(35-2)17-12-24)31(32)30-28-8-5-4-7-25(28)13-18-29(30)36-3/h4-5,7-18,31H,6,19-22H2,1-3H3/p+1