5-methyl-1-[2-oxidanyl-3-(propylamino)propyl]-2-phenyl-4-(3-phenylpropanoyl)pyrazol-3-one

Systemtic Name: 5-methyl-1-[2-oxidanyl-3-(propylamino)propyl]-2-phenyl-4-(3-phenylpropanoyl)pyrazol-3-one Openeye Name: 1-[2-hydroxy-3-(propylamino)propyl]-5-methyl-2-phenyl-4-(3-phenylpropanoyl)pyrazol-3-one CAS Name: 1-[2-hydroxy-3-(propylamino)propyl]-5-methyl-4-(1-oxo-3-phenylpropyl)-2-phenyl-3-pyrazolone IUPAC Name: 1-[2-hydroxy-3-(propylamino)propyl]-5-methyl-2-phenyl-4-(3-phenylpropanoyl)pyrazol-3-one Traditional Name: 4-hydrocinnamoyl-1-[2-hydroxy-3-(propylamino)propyl]-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C25H31N3O3 MolecularWeight: 421.53194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNCC(CN1C(=C(C(=O)N1C2=CC=CC=C2)C(=O)CCC3=CC=CC=C3)C)O

Isomeric SMILES

CCCNCC(CN1C(=C(C(=O)N1C2=CC=CC=C2)C(=O)CCC3=CC=CC=C3)C)O

InChI

InChI=1S/C25H31N3O3/c1-3-16-26-17-22(29)18-27-19(2)24(23(30)15-14-20-10-6-4-7-11-20)25(31)28(27)21-12-8-5-9-13-21/h4-13,22,26,29H,3,14-18H2,1-2H3