2-[(2S)-2-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]pyrrolidin-1-yl]-4-phenyl-butanoic acid

Systemtic Name: 2-[(2S)-2-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]carbamoyl]pyrrolidin-1-yl]-4-phenyl-butanoic acid Openeye Name: 2-[(2S)-2-[[(1S)-2-amino-1-methyl-2-oxo-ethyl]carbamoyl]pyrrolidin-1-yl]-4-phenyl-butanoic acid CAS Name: 2-[(2S)-2-[[[(2S)-1-amino-1-oxopropan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-4-phenylbutanoic acid IUPAC Name: 2-[(2S)-2-[[(2S)-1-amino-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-4-phenylbutanoic acid Traditional Name: 2-[(2S)-2-[[(1S)-2-amino-2-keto-1-methyl-ethyl]carbamoyl]pyrrolidino]-4-phenyl-butyric acid Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)NC(=O)C1CCCN1C(CCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C[C@@H](C(=O)N)NC(=O)[C@@H]1CCCN1C(CCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H25N3O4/c1-12(16(19)22)20-17(23)14-8-5-11-21(14)15(18(24)25)10-9-13-6-3-2-4-7-13/h2-4,6-7,12,14-15H,5,8-11H2,1H3,(H2,19,22)(H,20,23)(H,24,25)/t12-,14-,15?/m0/s1