disodium 4-methyl-2-[1-[[3-[(2-oxidanidyl-2-oxidanylidene-ethyl)carbamoyl]-4-oxidanyl-phenyl]methylamino]-1-oxidanylidene-propan-2-yl]hexanoate

Systemtic Name: disodium 4-methyl-2-[1-[[3-[(2-oxidanidyl-2-oxidanylidene-ethyl)carbamoyl]-4-oxidanyl-phenyl]methylamino]-1-oxidanylidene-propan-2-yl]hexanoate Openeye Name: disodium 2-[2-[[4-hydroxy-3-[(2-oxido-2-oxo-ethyl)carbamoyl]phenyl]methylamino]-1-methyl-2-oxo-ethyl]-4-methyl-hexanoate CAS Name: disodium 2-[1-[[4-hydroxy-3-[[(2-oxido-2-oxoethyl)amino]-oxomethyl]phenyl]methylamino]-1-oxopropan-2-yl]-4-methylhexanoate IUPAC Name: disodium 2-[1-[[4-hydroxy-3-[(2-oxido-2-oxoethyl)carbamoyl]phenyl]methylamino]-1-oxopropan-2-yl]-4-methylhexanoate Traditional Name: disodium 2-[2-[[4-hydroxy-3-[(2-keto-2-oxido-ethyl)carbamoyl]benzyl]amino]-2-keto-1-methyl-ethyl]-4-methyl-hexanoate Formula: C20H26N2Na2O7 MolecularWeight: 452.40918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(C(C)C(=O)NCC1=CC(=C(C=C1)O)C(=O)NCC(=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCC(C)CC(C(C)C(=O)NCC1=CC(=C(C=C1)O)C(=O)NCC(=O)[O-])C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C20H28N2O7.2Na/c1-4-11(2)7-14(20(28)29)12(3)18(26)21-9-13-5-6-16(23)15(8-13)19(27)22-10-17(24)25;;/h5-6,8,11-12,14,23H,4,7,9-10H2,1-3H3,(H,21,26)(H,22,27)(H,24,25)(H,28,29);;/q;2*+1/p-2