4-[[(2S)-1-[(3R)-3-azanyl-4-phenyl-butanoyl]pyrrolidin-2-yl]carbonylamino]butanoic acid

Systemtic Name: 4-[[(2S)-1-[(3R)-3-azanyl-4-phenyl-butanoyl]pyrrolidin-2-yl]carbonylamino]butanoic acid Openeye Name: 4-[[(2S)-1-[(3R)-3-amino-4-phenyl-butanoyl]pyrrolidine-2-carbonyl]amino]butanoic acid CAS Name: 4-[[[(2S)-1-[(3R)-3-amino-1-oxo-4-phenylbutyl]-2-pyrrolidinyl]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[[(2S)-1-[(3R)-3-amino-4-phenylbutanoyl]pyrrolidine-2-carbonyl]amino]butanoic acid Traditional Name: 4-[[(2S)-1-[(3R)-3-amino-4-phenyl-butanoyl]prolyl]amino]butyric acid Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(CC2=CC=CC=C2)N)C(=O)NCCCC(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C[C@@H](CC2=CC=CC=C2)N)C(=O)NCCCC(=O)O

InChI

InChI=1S/C19H27N3O4/c20-15(12-14-6-2-1-3-7-14)13-17(23)22-11-5-8-16(22)19(26)21-10-4-9-18(24)25/h1-3,6-7,15-16H,4-5,8-13,20H2,(H,21,26)(H,24,25)/t15-,16+/m1/s1