1-[4-[3-(3-azanyl-4-ethanoyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-3-propyl-phenyl]-2-oxidanyl-ethanone

Systemtic Name: 1-[4-[3-(3-azanyl-4-ethanoyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-3-propyl-phenyl]-2-oxidanyl-ethanone Openeye Name: 1-[4-[3-(4-acetyl-3-amino-2-propyl-phenoxy)-2-hydroxy-propoxy]-3-propyl-phenyl]-2-hydroxy-ethanone CAS Name: 1-[4-[3-(4-acetyl-3-amino-2-propylphenoxy)-2-hydroxypropoxy]-3-propylphenyl]-2-hydroxyethanone IUPAC Name: 1-[4-[3-(4-acetyl-3-amino-2-propylphenoxy)-2-hydroxypropoxy]-3-propylphenyl]-2-hydroxyethanone Traditional Name: 1-[4-[3-(4-acetyl-3-amino-2-propyl-phenoxy)-2-hydroxy-propoxy]-3-propyl-phenyl]-2-hydroxy-ethanone Formula: C25H33NO6 MolecularWeight: 443.53262

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)CO)OCC(COC2=C(C(=C(C=C2)C(=O)C)N)CCC)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)CO)OCC(COC2=C(C(=C(C=C2)C(=O)C)N)CCC)O

InChI

InChI=1S/C25H33NO6/c1-4-6-18-12-17(22(30)13-27)8-10-23(18)31-14-19(29)15-32-24-11-9-20(16(3)28)25(26)21(24)7-5-2/h8-12,19,27,29H,4-7,13-15,26H2,1-3H3