sodium 3-[[1-oxidanylidene-1-[(2-oxidanylidene-2-propoxy-ethyl)amino]-3-phenyl-propan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: sodium 3-[[1-oxidanylidene-1-[(2-oxidanylidene-2-propoxy-ethyl)amino]-3-phenyl-propan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: sodium 3-[[1-benzyl-2-oxo-2-[(2-oxo-2-propoxy-ethyl)amino]ethyl]carbamoyl]oxirane-2-carboxylate CAS Name: sodium 3-[oxo-[[1-oxo-1-[(2-oxo-2-propoxyethyl)amino]-3-phenylpropan-2-yl]amino]methyl]-2-oxiranecarboxylate IUPAC Name: sodium 3-[[1-oxo-1-[(2-oxo-2-propoxyethyl)amino]-3-phenylpropan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: sodium 3-[[1-benzyl-2-keto-2-[(2-keto-2-propoxy-ethyl)amino]ethyl]carbamoyl]oxirane-2-carboxylate Formula: C18H21N2NaO7 MolecularWeight: 400.35831

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)[O-].[Na+]

Isomeric SMILES

CCCOC(=O)CNC(=O)C(CC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)[O-].[Na+]

InChI

InChI=1S/C18H22N2O7.Na/c1-2-8-26-13(21)10-19-16(22)12(9-11-6-4-3-5-7-11)20-17(23)14-15(27-14)18(24)25;/h3-7,12,14-15H,2,8-10H2,1H3,(H,19,22)(H,20,23)(H,24,25);/q;+1/p-1