(2S)-3-[4-(6-azanylhexoxy)phenyl]-2-(butanoylamino)propanoic acid

Systemtic Name: (2S)-3-[4-(6-azanylhexoxy)phenyl]-2-(butanoylamino)propanoic acid Openeye Name: (2S)-3-[4-(6-aminohexoxy)phenyl]-2-(butanoylamino)propanoic acid CAS Name: (2S)-3-[4-(6-aminohexoxy)phenyl]-2-(1-oxobutylamino)propanoic acid IUPAC Name: (2S)-3-[4-(6-aminohexoxy)phenyl]-2-(butanoylamino)propanoic acid Traditional Name: (2S)-3-[4-(6-aminohexoxy)phenyl]-2-butyramido-propionic acid Formula: C19H30N2O4 MolecularWeight: 350.4525

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(CC1=CC=C(C=C1)OCCCCCCN)C(=O)O

Isomeric SMILES

CCCC(=O)N[C@@H](CC1=CC=C(C=C1)OCCCCCCN)C(=O)O

InChI

InChI=1S/C19H30N2O4/c1-2-7-18(22)21-17(19(23)24)14-15-8-10-16(11-9-15)25-13-6-4-3-5-12-20/h8-11,17H,2-7,12-14,20H2,1H3,(H,21,22)(H,23,24)/t17-/m0/s1