3,6-dimethoxy-4,5-bis(piperidin-1-ylmethyl)xanthen-9-one

Systemtic Name: 3,6-dimethoxy-4,5-bis(piperidin-1-ylmethyl)xanthen-9-one Openeye Name: 3,6-dimethoxy-4,5-bis(1-piperidylmethyl)xanthen-9-one CAS Name: 3,6-dimethoxy-4,5-bis(1-piperidinylmethyl)-9-xanthenone IUPAC Name: 3,6-dimethoxy-4,5-bis(piperidin-1-ylmethyl)xanthen-9-one Traditional Name: 3,6-dimethoxy-4,5-bis(piperidinomethyl)xanthone Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=O)C3=C(O2)C(=C(C=C3)OC)CN4CCCCC4)CN5CCCCC5

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=O)C3=C(O2)C(=C(C=C3)OC)CN4CCCCC4)CN5CCCCC5

InChI

InChI=1S/C27H34N2O4/c1-31-23-11-9-19-25(30)20-10-12-24(32-2)22(18-29-15-7-4-8-16-29)27(20)33-26(19)21(23)17-28-13-5-3-6-14-28/h9-12H,3-8,13-18H2,1-2H3