sodium 2-(aziridin-1-yl)-4-(4-chlorophenyl)-4-oxidanylidene-butanoate

Systemtic Name: sodium 2-(aziridin-1-yl)-4-(4-chlorophenyl)-4-oxidanylidene-butanoate Openeye Name: sodium 2-(aziridin-1-yl)-4-(4-chlorophenyl)-4-oxo-butanoate CAS Name: sodium 2-(1-aziridinyl)-4-(4-chlorophenyl)-4-oxobutanoate IUPAC Name: sodium 2-(aziridin-1-yl)-4-(4-chlorophenyl)-4-oxobutanoate Traditional Name: sodium 4-(4-chlorophenyl)-2-ethylenimino-4-keto-butyrate Formula: C12H11ClNNaO3 MolecularWeight: 275.66341

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)[O-].[Na+]

Isomeric SMILES

C1CN1C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)[O-].[Na+]

InChI

InChI=1S/C12H12ClNO3.Na/c13-9-3-1-8(2-4-9)11(15)7-10(12(16)17)14-5-6-14;/h1-4,10H,5-7H2,(H,16,17);/q;+1/p-1