3-methoxy-4-[(Z)-3-piperidin-1-ylprop-1-enyl]xanthen-9-one hydrochloride

Systemtic Name: 3-methoxy-4-[(Z)-3-piperidin-1-ylprop-1-enyl]xanthen-9-one hydrochloride Openeye Name: 3-methoxy-4-[(Z)-3-(1-piperidyl)prop-1-enyl]xanthen-9-one hydrochloride CAS Name: 3-methoxy-4-[(Z)-3-(1-piperidinyl)prop-1-enyl]-9-xanthenone hydrochloride IUPAC Name: 3-methoxy-4-[(Z)-3-piperidin-1-ylprop-1-enyl]xanthen-9-one hydrochloride Traditional Name: 3-methoxy-4-[(Z)-3-piperidinoprop-1-enyl]xanthone hydrochloride Formula: C22H24ClNO3 MolecularWeight: 385.88386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)C=CCN4CCCCC4.Cl

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)/C=C\CN4CCCCC4.Cl

InChI

InChI=1S/C22H23NO3.ClH/c1-25-19-12-11-18-21(24)16-8-3-4-10-20(16)26-22(18)17(19)9-7-15-23-13-5-2-6-14-23;/h3-4,7-12H,2,5-6,13-15H2,1H3;1H/b9-7-;