5-[1-(3-nitrophenyl)propyl]-2-phenethyl-2-propyl-3H-pyran-6-one

Systemtic Name: 5-[1-(3-nitrophenyl)propyl]-2-phenethyl-2-propyl-3H-pyran-6-one Openeye Name: 5-[1-(3-nitrophenyl)propyl]-2-phenethyl-2-propyl-3H-pyran-6-one CAS Name: 5-[1-(3-nitrophenyl)propyl]-2-phenethyl-2-propyl-3H-pyran-6-one IUPAC Name: 5-[1-(3-nitrophenyl)propyl]-2-phenethyl-2-propyl-3H-pyran-6-one Traditional Name: 5-[1-(3-nitrophenyl)propyl]-2-phenethyl-2-propyl-3H-pyran-6-one Formula: C25H29NO4 MolecularWeight: 407.50206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC=C(C(=O)O1)C(CC)C2=CC(=CC=C2)[N+](=O)[O-])CCC3=CC=CC=C3

Isomeric SMILES

CCCC1(CC=C(C(=O)O1)C(CC)C2=CC(=CC=C2)[N+](=O)[O-])CCC3=CC=CC=C3

InChI

InChI=1S/C25H29NO4/c1-3-15-25(16-13-19-9-6-5-7-10-19)17-14-23(24(27)30-25)22(4-2)20-11-8-12-21(18-20)26(28)29/h5-12,14,18,22H,3-4,13,15-17H2,1-2H3