5-ethyl-2-(3-methylbutyl)-3-(3-methylbutylamino)-6-oxidanyl-2-phenyl-3H-pyran-4-one

Systemtic Name: 5-ethyl-2-(3-methylbutyl)-3-(3-methylbutylamino)-6-oxidanyl-2-phenyl-3H-pyran-4-one Openeye Name: 5-ethyl-6-hydroxy-2-isopentyl-3-(isopentylamino)-2-phenyl-3H-pyran-4-one CAS Name: 5-ethyl-6-hydroxy-2-(3-methylbutyl)-3-(3-methylbutylamino)-2-phenyl-3H-pyran-4-one IUPAC Name: 5-ethyl-6-hydroxy-2-(3-methylbutyl)-3-(3-methylbutylamino)-2-phenyl-3H-pyran-4-one Traditional Name: 5-ethyl-6-hydroxy-2-isoamyl-3-(isoamylamino)-2-phenyl-3H-pyran-4-one Formula: C23H35NO3 MolecularWeight: 373.5289

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC(C(C1=O)NCCC(C)C)(CCC(C)C)C2=CC=CC=C2)O

Isomeric SMILES

CCC1=C(OC(C(C1=O)NCCC(C)C)(CCC(C)C)C2=CC=CC=C2)O

InChI

InChI=1S/C23H35NO3/c1-6-19-20(25)21(24-15-13-17(4)5)23(27-22(19)26,14-12-16(2)3)18-10-8-7-9-11-18/h7-11,16-17,21,24,26H,6,12-15H2,1-5H3