3-[[1-[hexyl(methyl)amino]-4-methyl-pentan-2-yl]carbamoyl]oxirane-2-carboxylic acid

Systemtic Name: 3-[[1-[hexyl(methyl)amino]-4-methyl-pentan-2-yl]carbamoyl]oxirane-2-carboxylic acid Openeye Name: 3-[[1-[[hexyl(methyl)amino]methyl]-3-methyl-butyl]carbamoyl]oxirane-2-carboxylic acid CAS Name: 3-[[[1-[hexyl(methyl)amino]-4-methylpentan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid IUPAC Name: 3-[[1-[hexyl(methyl)amino]-4-methylpentan-2-yl]carbamoyl]oxirane-2-carboxylic acid Traditional Name: 3-[[1-[[hexyl(methyl)amino]methyl]-3-methyl-butyl]carbamoyl]oxirane-2-carboxylic acid Formula: C17H32N2O4 MolecularWeight: 328.44698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C)CC(CC(C)C)NC(=O)C1C(O1)C(=O)O

Isomeric SMILES

CCCCCCN(C)CC(CC(C)C)NC(=O)C1C(O1)C(=O)O

InChI

InChI=1S/C17H32N2O4/c1-5-6-7-8-9-19(4)11-13(10-12(2)3)18-16(20)14-15(23-14)17(21)22/h12-15H,5-11H2,1-4H3,(H,18,20)(H,21,22)