sodium (Z)-13-(4-pentyl-1,2,3-triazol-1-yl)tridec-8-enoate

Systemtic Name: sodium (Z)-13-(4-pentyl-1,2,3-triazol-1-yl)tridec-8-enoate Openeye Name: sodium (Z)-13-(4-pentyltriazol-1-yl)tridec-8-enoate CAS Name: sodium (Z)-13-(4-pentyl-1-triazolyl)-8-tridecenoate IUPAC Name: sodium (Z)-13-(4-pentyltriazol-1-yl)tridec-8-enoate Traditional Name: sodium (Z)-13-(4-amyltriazol-1-yl)tridec-8-enoate Formula: C20H34N3NaO2 MolecularWeight: 371.49263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN(N=N1)CCCCC=CCCCCCCC(=O)[O-].[Na+]

Isomeric SMILES

CCCCCC1=CN(N=N1)CCCC/C=C\CCCCCCC(=O)[O-].[Na+]

InChI

InChI=1S/C20H35N3O2.Na/c1-2-3-12-15-19-18-23(22-21-19)17-14-11-9-7-5-4-6-8-10-13-16-20(24)25;/h5,7,18H,2-4,6,8-17H2,1H3,(H,24,25);/q;+1/p-1/b7-5-;