2,3-dimethyl-6-[3-(methylamino)but-1-ynyl]xanthen-9-one

Systemtic Name: 2,3-dimethyl-6-[3-(methylamino)but-1-ynyl]xanthen-9-one Openeye Name: 2,3-dimethyl-6-[3-(methylamino)but-1-ynyl]xanthen-9-one CAS Name: 2,3-dimethyl-6-[3-(methylamino)but-1-ynyl]-9-xanthenone IUPAC Name: 2,3-dimethyl-6-[3-(methylamino)but-1-ynyl]xanthen-9-one Traditional Name: 2,3-dimethyl-6-[3-(methylamino)but-1-ynyl]xanthone Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C3=C(O2)C=C(C=C3)C#CC(C)NC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C3=C(O2)C=C(C=C3)C#CC(C)NC)C

InChI

InChI=1S/C20H19NO2/c1-12-9-17-18(10-13(12)2)23-19-11-15(6-5-14(3)21-4)7-8-16(19)20(17)22/h7-11,14,21H,1-4H3