potassium 3-[[4-methyl-1-oxidanylidene-1-(phenethylamino)pentan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: potassium 3-[[4-methyl-1-oxidanylidene-1-(phenethylamino)pentan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: potassium 3-[[3-methyl-1-(phenethylcarbamoyl)butyl]carbamoyl]oxirane-2-carboxylate CAS Name: potassium 3-[[[4-methyl-1-oxo-1-(phenethylamino)pentan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylate IUPAC Name: potassium 3-[[4-methyl-1-oxo-1-(phenethylamino)pentan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: potassium 3-[[3-methyl-1-(phenethylcarbamoyl)butyl]carbamoyl]oxirane-2-carboxylate Formula: C18H23KN2O5 MolecularWeight: 386.48392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCCC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)[O-].[K+]

Isomeric SMILES

CC(C)CC(C(=O)NCCC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)[O-].[K+]

InChI

InChI=1S/C18H24N2O5.K/c1-11(2)10-13(20-17(22)14-15(25-14)18(23)24)16(21)19-9-8-12-6-4-3-5-7-12;/h3-7,11,13-15H,8-10H2,1-2H3,(H,19,21)(H,20,22)(H,23,24);/q;+1/p-1