(6-methoxy-2H-chromen-3-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (6-methoxy-2H-chromen-3-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Openeye Name: (6-methoxy-2H-chromen-3-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium CAS Name: (6-methoxy-2H-1-benzopyran-3-yl)methyl-phenethyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (6-methoxy-2H-chromen-3-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Traditional Name: (6-methoxy-2H-chromen-3-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium Formula: C25H27N2O2+ MolecularWeight: 387.49408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(=C2)C[NH+](CCC3=CC=CC=C3)CC4=CC=NC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)OCC(=C2)C[NH+](CCC3=CC=CC=C3)CC4=CC=NC=C4

InChI

InChI=1S/C25H26N2O2/c1-28-24-7-8-25-23(16-24)15-22(19-29-25)18-27(17-21-9-12-26-13-10-21)14-11-20-5-3-2-4-6-20/h2-10,12-13,15-16H,11,14,17-19H2,1H3/p+1