5-[2-cyclohexyl-1-(3-methylbutylamino)ethyl]-2-(3-methylbutyl)-6-oxidanyl-2-phenyl-3H-pyran-4-one

Systemtic Name: 5-[2-cyclohexyl-1-(3-methylbutylamino)ethyl]-2-(3-methylbutyl)-6-oxidanyl-2-phenyl-3H-pyran-4-one Openeye Name: 5-[2-cyclohexyl-1-(isopentylamino)ethyl]-6-hydroxy-2-isopentyl-2-phenyl-3H-pyran-4-one CAS Name: 5-[2-cyclohexyl-1-(3-methylbutylamino)ethyl]-6-hydroxy-2-(3-methylbutyl)-2-phenyl-3H-pyran-4-one IUPAC Name: 5-[2-cyclohexyl-1-(3-methylbutylamino)ethyl]-6-hydroxy-2-(3-methylbutyl)-2-phenyl-3H-pyran-4-one Traditional Name: 5-[2-cyclohexyl-1-(isoamylamino)ethyl]-6-hydroxy-2-isoamyl-2-phenyl-3H-pyran-4-one Formula: C29H45NO3 MolecularWeight: 455.6725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CC(=O)C(=C(O1)O)C(CC2CCCCC2)NCCC(C)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCC1(CC(=O)C(=C(O1)O)C(CC2CCCCC2)NCCC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C29H45NO3/c1-21(2)15-17-29(24-13-9-6-10-14-24)20-26(31)27(28(32)33-29)25(30-18-16-22(3)4)19-23-11-7-5-8-12-23/h6,9-10,13-14,21-23,25,30,32H,5,7-8,11-12,15-20H2,1-4H3