nonyl 2-[[4-cyano-6-[(2-nonoxy-2-oxidanylidene-ethyl)amino]-1,3,5-triazin-2-yl]amino]ethanoate

Systemtic Name: nonyl 2-[[4-cyano-6-[(2-nonoxy-2-oxidanylidene-ethyl)amino]-1,3,5-triazin-2-yl]amino]ethanoate Openeye Name: nonyl 2-[[4-cyano-6-[(2-nonoxy-2-oxo-ethyl)amino]-1,3,5-triazin-2-yl]amino]acetate CAS Name: 2-[[4-cyano-6-[(2-nonoxy-2-oxoethyl)amino]-1,3,5-triazin-2-yl]amino]acetic acid nonyl ester IUPAC Name: nonyl 2-[[4-cyano-6-[(2-nonoxy-2-oxoethyl)amino]-1,3,5-triazin-2-yl]amino]acetate Traditional Name: 2-[[4-cyano-6-[(2-keto-2-nonoxy-ethyl)amino]-s-triazin-2-yl]amino]acetic acid nonyl ester Formula: C26H44N6O4 MolecularWeight: 504.66536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)CNC1=NC(=NC(=N1)C#N)NCC(=O)OCCCCCCCCC

Isomeric SMILES

CCCCCCCCCOC(=O)CNC1=NC(=NC(=N1)C#N)NCC(=O)OCCCCCCCCC

InChI

InChI=1S/C26H44N6O4/c1-3-5-7-9-11-13-15-17-35-23(33)20-28-25-30-22(19-27)31-26(32-25)29-21-24(34)36-18-16-14-12-10-8-6-4-2/h3-18,20-21H2,1-2H3,(H2,28,29,30,31,32)