6-azanyl-2-[[(2R)-3-(1H-imidazol-5-yl)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]carbamoyl]hexanoic acid

Systemtic Name: 6-azanyl-2-[[(2R)-3-(1H-imidazol-5-yl)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]carbamoyl]hexanoic acid Openeye Name: 6-amino-2-[[(1R)-1-(1H-imidazol-5-ylmethyl)-2-oxo-2-pyrrolidin-1-yl-ethyl]carbamoyl]hexanoic acid CAS Name: 6-amino-2-[[[(2R)-3-(1H-imidazol-5-yl)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]amino]-oxomethyl]hexanoic acid IUPAC Name: 6-amino-2-[[(2R)-3-(1H-imidazol-5-yl)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]carbamoyl]hexanoic acid Traditional Name: 6-amino-2-[[(1R)-1-(1H-imidazol-5-ylmethyl)-2-keto-2-pyrrolidino-ethyl]carbamoyl]hexanoic acid Formula: C17H27N5O4 MolecularWeight: 365.42738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(CC2=CN=CN2)NC(=O)C(CCCCN)C(=O)O

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H](CC2=CN=CN2)NC(=O)C(CCCCN)C(=O)O

InChI

InChI=1S/C17H27N5O4/c18-6-2-1-5-13(17(25)26)15(23)21-14(9-12-10-19-11-20-12)16(24)22-7-3-4-8-22/h10-11,13-14H,1-9,18H2,(H,19,20)(H,21,23)(H,25,26)/t13?,14-/m1/s1