3-azanyl-4-[2-[3-[2,4-bis(oxidanyl)phenyl]propanoyl]-4-phenyl-piperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: 3-azanyl-4-[2-[3-[2,4-bis(oxidanyl)phenyl]propanoyl]-4-phenyl-piperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: 3-amino-4-[2-[3-(2,4-dihydroxyphenyl)propanoyl]-4-phenyl-piperazin-1-yl]-4-oxo-butanamide CAS Name: 3-amino-4-[2-[3-(2,4-dihydroxyphenyl)-1-oxopropyl]-4-phenyl-1-piperazinyl]-4-oxobutanamide IUPAC Name: 3-amino-4-[2-[3-(2,4-dihydroxyphenyl)propanoyl]-4-phenylpiperazin-1-yl]-4-oxobutanamide Traditional Name: 3-amino-4-[2-[3-(2,4-dihydroxyphenyl)propanoyl]-4-phenyl-piperazino]-4-keto-butyramide Formula: C23H28N4O5 MolecularWeight: 440.49222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C2=CC=CC=C2)C(=O)CCC3=C(C=C(C=C3)O)O)C(=O)C(CC(=O)N)N

Isomeric SMILES

C1CN(C(CN1C2=CC=CC=C2)C(=O)CCC3=C(C=C(C=C3)O)O)C(=O)C(CC(=O)N)N

InChI

InChI=1S/C23H28N4O5/c24-18(13-22(25)31)23(32)27-11-10-26(16-4-2-1-3-5-16)14-19(27)20(29)9-7-15-6-8-17(28)12-21(15)30/h1-6,8,12,18-19,28,30H,7,9-11,13-14,24H2,(H2,25,31)