4-methyl-2-[[4-methyl-2-(pyrrolidin-1-ium-2-ylcarbonylamino)pentanoyl]amino]pentanoate

Systemtic Name: 4-methyl-2-[[4-methyl-2-(pyrrolidin-1-ium-2-ylcarbonylamino)pentanoyl]amino]pentanoate Openeye Name: 4-methyl-2-[[4-methyl-2-(pyrrolidin-1-ium-2-carbonylamino)pentanoyl]amino]pentanoate CAS Name: 4-methyl-2-[[4-methyl-1-oxo-2-[[oxo(2-pyrrolidin-1-iumyl)methyl]amino]pentyl]amino]pentanoate IUPAC Name: 4-methyl-2-[[4-methyl-2-(pyrrolidin-1-ium-2-carbonylamino)pentanoyl]amino]pentanoate Traditional Name: 4-methyl-2-[[4-methyl-2-(pyrrolidin-1-ium-2-carbonylamino)pentanoyl]amino]valerate Formula: C17H31N3O4 MolecularWeight: 341.44574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(C)C)C(=O)[O-])NC(=O)C1CCC[NH2+]1

Isomeric SMILES

CC(C)CC(C(=O)NC(CC(C)C)C(=O)[O-])NC(=O)C1CCC[NH2+]1

InChI

InChI=1S/C17H31N3O4/c1-10(2)8-13(19-15(21)12-6-5-7-18-12)16(22)20-14(17(23)24)9-11(3)4/h10-14,18H,5-9H2,1-4H3,(H,19,21)(H,20,22)(H,23,24)