(6-methyl-4-oxidanylidene-chromen-3-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (6-methyl-4-oxidanylidene-chromen-3-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Openeye Name: (6-methyl-4-oxo-chromen-3-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium CAS Name: (6-methyl-4-oxo-1-benzopyran-3-yl)methyl-phenethyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (6-methyl-4-oxochromen-3-yl)methyl-phenethyl-(pyridin-4-ylmethyl)azanium Traditional Name: (4-keto-6-methyl-chromen-3-yl)methyl-phenethyl-(4-pyridylmethyl)ammonium Formula: C25H25N2O2+ MolecularWeight: 385.4782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC=C(C2=O)C[NH+](CCC3=CC=CC=C3)CC4=CC=NC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)OC=C(C2=O)C[NH+](CCC3=CC=CC=C3)CC4=CC=NC=C4

InChI

InChI=1S/C25H24N2O2/c1-19-7-8-24-23(15-19)25(28)22(18-29-24)17-27(16-21-9-12-26-13-10-21)14-11-20-5-3-2-4-6-20/h2-10,12-13,15,18H,11,14,16-17H2,1H3/p+1