sodium 4-[[(2R,4S)-4-methoxy-5-oxidanyl-5-oxidanylidene-1-(4-phenylphenyl)pentan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: sodium 4-[[(2R,4S)-4-methoxy-5-oxidanyl-5-oxidanylidene-1-(4-phenylphenyl)pentan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: sodium 4-[[(1R,3S)-4-hydroxy-3-methoxy-4-oxo-1-[(4-phenylphenyl)methyl]butyl]amino]-4-oxo-butanoate CAS Name: sodium 4-[[(2R,4S)-5-hydroxy-4-methoxy-5-oxo-1-(4-phenylphenyl)pentan-2-yl]amino]-4-oxobutanoate IUPAC Name: sodium 4-[[(2R,4S)-5-hydroxy-4-methoxy-5-oxo-1-(4-phenylphenyl)pentan-2-yl]amino]-4-oxobutanoate Traditional Name: sodium 4-[[(1R,3S)-4-hydroxy-4-keto-3-methoxy-1-(4-phenylbenzyl)butyl]amino]-4-keto-butyrate Formula: C22H24NNaO6 MolecularWeight: 421.41883

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC(CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)CCC(=O)[O-])C(=O)O.[Na+]

Isomeric SMILES

CO[C@@H](C[C@@H](CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)CCC(=O)[O-])C(=O)O.[Na+]

InChI

InChI=1S/C22H25NO6.Na/c1-29-19(22(27)28)14-18(23-20(24)11-12-21(25)26)13-15-7-9-17(10-8-15)16-5-3-2-4-6-16;/h2-10,18-19H,11-14H2,1H3,(H,23,24)(H,25,26)(H,27,28);/q;+1/p-1/t18-,19+;/m1./s1