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(2S)-2-[4-(azepan-1-ylmethyl)phenoxy]propanoic acid

(2S)-2-[4-(azepan-1-ylmethyl)phenoxy]propanoic acid

Systemtic Name:(2S)-2-[4-(azepan-1-ylmethyl)phenoxy]propanoic acid
Openeye Name:(2S)-2-[4-(azepan-1-ylmethyl)phenoxy]propanoic acid
CAS Name:(2S)-2-[4-(1-azepanylmethyl)phenoxy]propanoic acid
IUPAC Name:(2S)-2-[4-(azepan-1-ylmethyl)phenoxy]propanoic acid
Traditional Name:(2S)-2-[4-(azepan-1-ylmethyl)phenoxy]propionic acid
Formula: C16H23NO3
MolecularWeight: 277.35872
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=C(C=C1)CN2CCCCCC2


Isomeric SMILES

C[C@@H](C(=O)O)OC1=CC=C(C=C1)CN2CCCCCC2


InChI

InChI=1S/C16H23NO3/c1-13(16(18)19)20-15-8-6-14(7-9-15)12-17-10-4-2-3-5-11-17/h6-9,13H,2-5,10-12H2,1H3,(H,18,19)/t13-/m0/s1


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