4-(9,9-dimethyldecyl)aniline; methyl dihydrogen phosphate

Systemtic Name: 4-(9,9-dimethyldecyl)aniline; methyl dihydrogen phosphate Openeye Name: 4-(9,9-dimethyldecyl)aniline; methyl dihydrogen phosphate CAS Name: 4-(9,9-dimethyldecyl)aniline; methyl dihydrogen phosphate IUPAC Name: 4-(9,9-dimethyldecyl)aniline; methyl dihydrogen phosphate Traditional Name: [4-(9,9-dimethyldecyl)phenyl]amine; methyl dihydrogen phosphate Formula: C37H67N2O4P MolecularWeight: 634.912641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCCCCC1=CC=C(C=C1)N.CC(C)(C)CCCCCCCCC1=CC=C(C=C1)N.COP(=O)(O)O

Isomeric SMILES

CC(C)(C)CCCCCCCCC1=CC=C(C=C1)N.CC(C)(C)CCCCCCCCC1=CC=C(C=C1)N.COP(=O)(O)O

InChI

InChI=1S/2C18H31N.CH5O4P/c2*1-18(2,3)15-9-7-5-4-6-8-10-16-11-13-17(19)14-12-16;1-5-6(2,3)4/h2*11-14H,4-10,15,19H2,1-3H3;1H3,(H2,2,3,4)