(E)-2-azanyl-10-[(4-azidophenyl)carbonylamino]-4-(phosphonomethyl)dec-3-enoic acid

Systemtic Name: (E)-2-azanyl-10-[(4-azidophenyl)carbonylamino]-4-(phosphonomethyl)dec-3-enoic acid Openeye Name: (E)-2-amino-10-[(4-azidobenzoyl)amino]-4-(phosphonomethyl)dec-3-enoic acid CAS Name: (E)-2-amino-10-[[(4-azidophenyl)-oxomethyl]amino]-4-(phosphonomethyl)-3-decenoic acid IUPAC Name: (E)-2-amino-10-[(4-azidobenzoyl)amino]-4-(phosphonomethyl)dec-3-enoic acid Traditional Name: (E)-2-amino-10-[(4-azidobenzoyl)amino]-4-(phosphonomethyl)dec-3-enoic acid Formula: C18H26N5O6P MolecularWeight: 439.402701

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCCCCC(=CC(C(=O)O)N)CP(=O)(O)O)N=[N+]=[N-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCCCC/C(=C\C(C(=O)O)N)/CP(=O)(O)O)N=[N+]=[N-]

InChI

InChI=1S/C18H26N5O6P/c19-16(18(25)26)11-13(12-30(27,28)29)5-3-1-2-4-10-21-17(24)14-6-8-15(9-7-14)22-23-20/h6-9,11,16H,1-5,10,12,19H2,(H,21,24)(H,25,26)(H2,27,28,29)/b13-11+