2-[[2-[(2-azaniumyl-4-methyl-pentanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate

Systemtic Name: 2-[[2-[(2-azaniumyl-4-methyl-pentanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate Openeye Name: 2-[[2-[(2-azaniumyl-4-methyl-pentanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoate CAS Name: 2-[[2-[(2-ammonio-4-methyl-1-oxopentyl)amino]-3-methyl-1-oxobutyl]amino]-3-methylbutanoate IUPAC Name: 2-[[2-[(2-azaniumyl-4-methylpentanoyl)amino]-3-methylbutanoyl]amino]-3-methylbutanoate Traditional Name: 2-[[2-[(2-ammonio-4-methyl-pentanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butyrate Formula: C16H31N3O4 MolecularWeight: 329.43504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H31N3O4/c1-8(2)7-11(17)14(20)18-12(9(3)4)15(21)19-13(10(5)6)16(22)23/h8-13H,7,17H2,1-6H3,(H,18,20)(H,19,21)(H,22,23)