methyl 5-[5-(2-azanylethyl)-2-oxidanyl-phenoxy]pentanoate

Systemtic Name: methyl 5-[5-(2-azanylethyl)-2-oxidanyl-phenoxy]pentanoate Openeye Name: methyl 5-[5-(2-aminoethyl)-2-hydroxy-phenoxy]pentanoate CAS Name: 5-[5-(2-aminoethyl)-2-hydroxyphenoxy]pentanoic acid methyl ester IUPAC Name: methyl 5-[5-(2-aminoethyl)-2-hydroxyphenoxy]pentanoate Traditional Name: 5-[5-(2-aminoethyl)-2-hydroxy-phenoxy]valeric acid methyl ester Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCOC1=C(C=CC(=C1)CCN)O

Isomeric SMILES

COC(=O)CCCCOC1=C(C=CC(=C1)CCN)O

InChI

InChI=1S/C14H21NO4/c1-18-14(17)4-2-3-9-19-13-10-11(7-8-15)5-6-12(13)16/h5-6,10,16H,2-4,7-9,15H2,1H3