(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(1R)-1-(3,4-dipropoxyphenyl)ethyl]azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(1R)-1-(3,4-dipropoxyphenyl)ethyl]azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-[(1R)-1-(3,4-dipropoxyphenyl)ethyl]ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[(1R)-1-(3,4-dipropoxyphenyl)ethyl]ammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-[(1R)-1-(3,4-dipropoxyphenyl)ethyl]azanium Traditional Name: [(1R)-1-(3,4-dipropoxyphenyl)ethyl]-[(2-keto-7,8-dimethyl-chromen-4-yl)methyl]ammonium Formula: C26H34NO4+ MolecularWeight: 424.55246

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(C)[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3C)C)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@@H](C)[NH2+]CC2=CC(=O)OC3=C2C=CC(=C3C)C)OCCC

InChI

InChI=1S/C26H33NO4/c1-6-12-29-23-11-9-20(14-24(23)30-13-7-2)19(5)27-16-21-15-25(28)31-26-18(4)17(3)8-10-22(21)26/h8-11,14-15,19,27H,6-7,12-13,16H2,1-5H3/p+1/t19-/m1/s1