1-[4-[3-(5-azanyl-4-chloranyl-2-methyl-phenoxy)propoxy]-2-oxidanyl-3-propyl-phenyl]ethanone

Systemtic Name: 1-[4-[3-(5-azanyl-4-chloranyl-2-methyl-phenoxy)propoxy]-2-oxidanyl-3-propyl-phenyl]ethanone Openeye Name: 1-[4-[3-(5-amino-4-chloro-2-methyl-phenoxy)propoxy]-2-hydroxy-3-propyl-phenyl]ethanone CAS Name: 1-[4-[3-(5-amino-4-chloro-2-methylphenoxy)propoxy]-2-hydroxy-3-propylphenyl]ethanone IUPAC Name: 1-[4-[3-(5-amino-4-chloro-2-methylphenoxy)propoxy]-2-hydroxy-3-propylphenyl]ethanone Traditional Name: 1-[4-[3-(5-amino-4-chloro-2-methyl-phenoxy)propoxy]-2-hydroxy-3-propyl-phenyl]ethanone Formula: C21H26ClNO4 MolecularWeight: 391.88844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC(=C(C=C2C)Cl)N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC(=C(C=C2C)Cl)N

InChI

InChI=1S/C21H26ClNO4/c1-4-6-16-19(8-7-15(14(3)24)21(16)25)26-9-5-10-27-20-12-18(23)17(22)11-13(20)2/h7-8,11-12,25H,4-6,9-10,23H2,1-3H3