(2S)-2-[(4-octylphenyl)carbonylamino]propanoic acid

Systemtic Name: (2S)-2-[(4-octylphenyl)carbonylamino]propanoic acid Openeye Name: (2S)-2-[(4-octylbenzoyl)amino]propanoic acid CAS Name: (2S)-2-[[(4-octylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-[(4-octylbenzoyl)amino]propanoic acid Traditional Name: (2S)-2-[(4-octylbenzoyl)amino]propionic acid Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(=O)NC(C)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(=O)N[C@@H](C)C(=O)O

InChI

InChI=1S/C18H27NO3/c1-3-4-5-6-7-8-9-15-10-12-16(13-11-15)17(20)19-14(2)18(21)22/h10-14H,3-9H2,1-2H3,(H,19,20)(H,21,22)/t14-/m0/s1