2,7-bis(dimethylaminomethyl)-9-phenyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione

Systemtic Name: 2,7-bis(dimethylaminomethyl)-9-phenyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Openeye Name: 2,7-bis(dimethylaminomethyl)-9-phenyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione CAS Name: 2,7-bis(dimethylaminomethyl)-9-phenyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione IUPAC Name: 2,7-bis(dimethylaminomethyl)-9-phenyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione Traditional Name: 2,7-bis(dimethylaminomethyl)-9-phenyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-quinone Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCC2=C(C1=O)C(C3=C(O2)CCC(C3=O)CN(C)C)C4=CC=CC=C4

Isomeric SMILES

CN(C)CC1CCC2=C(C1=O)C(C3=C(O2)CCC(C3=O)CN(C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H32N2O3/c1-26(2)14-17-10-12-19-22(24(17)28)21(16-8-6-5-7-9-16)23-20(30-19)13-11-18(25(23)29)15-27(3)4/h5-9,17-18,21H,10-15H2,1-4H3