3-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)amino]-2-methyl-2-oxidanyl-3-oxidanylidene-propanoic acid; 2-butylguanidine

Systemtic Name: 3-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)amino]-2-methyl-2-oxidanyl-3-oxidanylidene-propanoic acid; 2-butylguanidine Openeye Name: 2-butylguanidine; 3-[(1-carbamoyl-3-methyl-butyl)amino]-2-hydroxy-2-methyl-3-oxo-propanoic acid CAS Name: 3-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-2-hydroxy-2-methyl-3-oxopropanoic acid; 2-butylguanidine IUPAC Name: 3-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-2-hydroxy-2-methyl-3-oxopropanoic acid; 2-butylguanidine Traditional Name: 2-butylguanidine; 3-[(1-carbamoyl-3-methyl-butyl)amino]-2-hydroxy-3-keto-2-methyl-propionic acid Formula: C15H31N5O5 MolecularWeight: 361.43714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(N)N.CC(C)CC(C(=O)N)NC(=O)C(C)(C(=O)O)O

Isomeric SMILES

CCCCN=C(N)N.CC(C)CC(C(=O)N)NC(=O)C(C)(C(=O)O)O

InChI

InChI=1S/C10H18N2O5.C5H13N3/c1-5(2)4-6(7(11)13)12-8(14)10(3,17)9(15)16;1-2-3-4-8-5(6)7/h5-6,17H,4H2,1-3H3,(H2,11,13)(H,12,14)(H,15,16);2-4H2,1H3,(H4,6,7,8)