[1-[(4-azanyl-6-phenyl-1,3,5-triazin-2-yl)-(hydroxymethyl)amino]-3-octoxy-3-octyl-undecan-2-yl] 2-methylprop-2-enoate

Systemtic Name: [1-[(4-azanyl-6-phenyl-1,3,5-triazin-2-yl)-(hydroxymethyl)amino]-3-octoxy-3-octyl-undecan-2-yl] 2-methylprop-2-enoate Openeye Name: [1-[[(4-amino-6-phenyl-1,3,5-triazin-2-yl)-(hydroxymethyl)amino]methyl]-2-octoxy-2-octyl-decyl] 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid [1-[(4-amino-6-phenyl-1,3,5-triazin-2-yl)-(hydroxymethyl)amino]-3-octoxy-3-octylundecan-2-yl] ester IUPAC Name: [1-[(4-amino-6-phenyl-1,3,5-triazin-2-yl)-(hydroxymethyl)amino]-3-octoxy-3-octylundecan-2-yl] 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid [1-[[(4-amino-6-phenyl-s-triazin-2-yl)-methylol-amino]methyl]-2-octoxy-2-octyl-decyl] ester Formula: C41H69N5O4 MolecularWeight: 696.01766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCC)(C(CN(CO)C1=NC(=NC(=N1)N)C2=CC=CC=C2)OC(=O)C(=C)C)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC(CCCCCCCC)(C(CN(CO)C1=NC(=NC(=N1)N)C2=CC=CC=C2)OC(=O)C(=C)C)OCCCCCCCC

InChI

InChI=1S/C41H69N5O4/c1-6-9-12-15-18-24-29-41(30-25-19-16-13-10-7-2,49-31-26-20-17-14-11-8-3)36(50-38(48)34(4)5)32-46(33-47)40-44-37(43-39(42)45-40)35-27-22-21-23-28-35/h21-23,27-28,36,47H,4,6-20,24-26,29-33H2,1-3,5H3,(H2,42,43,44,45)