sodium 3,4,5-tris[4-(prop-2-enoylamino)butoxy]benzoate

Systemtic Name: sodium 3,4,5-tris[4-(prop-2-enoylamino)butoxy]benzoate Openeye Name: sodium 3,4,5-tris[4-(prop-2-enoylamino)butoxy]benzoate CAS Name: sodium 3,4,5-tris[4-(1-oxoprop-2-enylamino)butoxy]benzoate IUPAC Name: sodium 3,4,5-tris[4-(prop-2-enoylamino)butoxy]benzoate Traditional Name: sodium 3,4,5-tris(4-acrylamidobutoxy)benzoate Formula: C28H38N3NaO8 MolecularWeight: 567.60639

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCCCCOC1=CC(=CC(=C1OCCCCNC(=O)C=C)OCCCCNC(=O)C=C)C(=O)[O-].[Na+]

Isomeric SMILES

C=CC(=O)NCCCCOC1=CC(=CC(=C1OCCCCNC(=O)C=C)OCCCCNC(=O)C=C)C(=O)[O-].[Na+]

InChI

InChI=1S/C28H39N3O8.Na/c1-4-24(32)29-13-7-10-16-37-22-19-21(28(35)36)20-23(38-17-11-8-14-30-25(33)5-2)27(22)39-18-12-9-15-31-26(34)6-3;/h4-6,19-20H,1-3,7-18H2,(H,29,32)(H,30,33)(H,31,34)(H,35,36);/q;+1/p-1