5-[1-(3-aminophenyl)propyl]-6-oxidanyl-2-phenethyl-2-propyl-3H-pyran-4-one

Systemtic Name: 5-[1-(3-aminophenyl)propyl]-6-oxidanyl-2-phenethyl-2-propyl-3H-pyran-4-one Openeye Name: 5-[1-(3-aminophenyl)propyl]-6-hydroxy-2-phenethyl-2-propyl-3H-pyran-4-one CAS Name: 5-[1-(3-aminophenyl)propyl]-6-hydroxy-2-phenethyl-2-propyl-3H-pyran-4-one IUPAC Name: 5-[1-(3-aminophenyl)propyl]-6-hydroxy-2-phenethyl-2-propyl-3H-pyran-4-one Traditional Name: 5-[1-(3-aminophenyl)propyl]-6-hydroxy-2-phenethyl-2-propyl-3H-pyran-4-one Formula: C25H31NO3 MolecularWeight: 393.51854

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=O)C(=C(O1)O)C(CC)C2=CC(=CC=C2)N)CCC3=CC=CC=C3

Isomeric SMILES

CCCC1(CC(=O)C(=C(O1)O)C(CC)C2=CC(=CC=C2)N)CCC3=CC=CC=C3

InChI

InChI=1S/C25H31NO3/c1-3-14-25(15-13-18-9-6-5-7-10-18)17-22(27)23(24(28)29-25)21(4-2)19-11-8-12-20(26)16-19/h5-12,16,21,28H,3-4,13-15,17,26H2,1-2H3