Structure

InChI Key PMPQCPQAHTXCDK-UHFFFAOYSA-M
Smiles C[N+](C)(CCOc1ccccc1)Cc1ccccc1.O=C([O-])c1cc2ccccc2cc1O
InChI
InChI=1S/C17H22NO.C11H8O3/c1-18(2,15-16-9-5-3-6-10-16)13-14-19-17-11-7-4-8-12-17;12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14/h3-12H,13-15H2,1-2H3;1-6,12H,(H,13,14)/q+1;/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C28H29NO4
Molecular Weight 443.54

Cross References

Resources Reference
ChEMBL CHEMBL1673148
FDA SRS 47RU9546DX
PubChem 54678490
SureChEMBL SCHEMBL466996