(2R)-2-[[(2S)-1-[(2R)-2-acetamido-6-azaniumyl-hexanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: (2R)-2-[[(2S)-1-[(2R)-2-acetamido-6-azaniumyl-hexanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-butanoate Openeye Name: (2R)-2-[[(2S)-1-[(2R)-2-acetamido-6-azaniumyl-hexanoyl]pyrrolidine-2-carbonyl]amino]-3-methyl-butanoate CAS Name: (2R)-2-[[[(2S)-1-[(2R)-2-acetamido-6-ammonio-1-oxohexyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2R)-2-[[(2S)-1-[(2R)-2-acetamido-6-azaniumylhexanoyl]pyrrolidine-2-carbonyl]amino]-3-methylbutanoate Traditional Name: (2R)-2-[[(2S)-1-[(2R)-2-acetamido-6-ammonio-hexanoyl]prolyl]amino]-3-methyl-butyrate Formula: C18H32N4O5 MolecularWeight: 384.47048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C1CCCN1C(=O)C(CCCC[NH3+])NC(=O)C

Isomeric SMILES

CC(C)[C@H](C(=O)[O-])NC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC[NH3+])NC(=O)C

InChI

InChI=1S/C18H32N4O5/c1-11(2)15(18(26)27)21-16(24)14-8-6-10-22(14)17(25)13(20-12(3)23)7-4-5-9-19/h11,13-15H,4-10,19H2,1-3H3,(H,20,23)(H,21,24)(H,26,27)/t13-,14+,15-/m1/s1