(2S)-2-[[(2S)-2-azanyl-6-(4-phenylbutanoylamino)hexanoyl]amino]propanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-azanyl-6-(4-phenylbutanoylamino)hexanoyl]amino]propanoic acid Openeye Name: (2S)-2-[[(2S)-2-amino-6-(4-phenylbutanoylamino)hexanoyl]amino]propanoic acid CAS Name: (2S)-2-[[(2S)-2-amino-1-oxo-6-[(1-oxo-4-phenylbutyl)amino]hexyl]amino]propanoic acid IUPAC Name: (2S)-2-[[(2S)-2-amino-6-(4-phenylbutanoylamino)hexanoyl]amino]propanoic acid Traditional Name: (2S)-2-[[(2S)-2-amino-6-(4-phenylbutanoylamino)hexanoyl]amino]propionic acid Formula: C19H29N3O4 MolecularWeight: 363.45126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(CCCCNC(=O)CCCC1=CC=CC=C1)N

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)[C@H](CCCCNC(=O)CCCC1=CC=CC=C1)N

InChI

InChI=1S/C19H29N3O4/c1-14(19(25)26)22-18(24)16(20)11-5-6-13-21-17(23)12-7-10-15-8-3-2-4-9-15/h2-4,8-9,14,16H,5-7,10-13,20H2,1H3,(H,21,23)(H,22,24)(H,25,26)/t14-,16-/m0/s1