sodium 5-azanyl-2-[[(Z)-6-diazonio-1-[[(Z)-6-diazonio-5-oxidanidyl-1-oxidanyl-1-oxidanylidene-hex-5-en-2-yl]amino]-5-oxidanidyl-1-oxidanylidene-hex-5-en-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: sodium 5-azanyl-2-[[(Z)-6-diazonio-1-[[(Z)-6-diazonio-5-oxidanidyl-1-oxidanyl-1-oxidanylidene-hex-5-en-2-yl]amino]-5-oxidanidyl-1-oxidanylidene-hex-5-en-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: sodium 5-amino-2-[[(Z)-1-[[(Z)-1-carboxy-5-diazonio-4-oxido-pent-4-enyl]carbamoyl]-5-diazonio-4-oxido-pent-4-enyl]amino]-5-oxo-pentanoate CAS Name: sodium 5-amino-2-[[(Z)-6-diazonio-1-[[(Z)-6-diazonio-1-hydroxy-5-oxido-1-oxohex-5-en-2-yl]amino]-5-oxido-1-oxohex-5-en-2-yl]amino]-5-oxopentanoate IUPAC Name: sodium 5-amino-2-[[(Z)-6-diazonio-1-[[(Z)-6-diazonio-1-hydroxy-5-oxido-1-oxohex-5-en-2-yl]amino]-5-oxido-1-oxohex-5-en-2-yl]amino]-5-oxopentanoate Traditional Name: sodium 5-amino-2-[[(Z)-1-[[(Z)-1-carboxy-5-diazonio-4-oxido-pent-4-enyl]carbamoyl]-5-diazonio-4-oxido-pent-4-enyl]amino]-5-keto-valerate Formula: C17H22N7NaO8 MolecularWeight: 475.38845

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=C[N+]#N)[O-])C(C(=O)NC(CCC(=C[N+]#N)[O-])C(=O)O)NC(CCC(=O)N)C(=O)[O-].[Na+]

Isomeric SMILES

C(C/C(=C/[N+]#N)/[O-])C(C(=O)NC(CC/C(=C/[N+]#N)/[O-])C(=O)O)NC(CCC(=O)N)C(=O)[O-].[Na+]

InChI

InChI=1S/C17H23N7O8.Na/c18-14(27)6-5-12(16(29)30)23-11(3-1-9(25)7-21-19)15(28)24-13(17(31)32)4-2-10(26)8-22-20;/h7-8,11-13,23H,1-6H2,(H5-2,18,24,25,26,27,28,29,30,31,32);/q;+1/p-1/b9-7-,10-8-;