5-(4-azanylbutyl)-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol

Systemtic Name: 5-(4-azanylbutyl)-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol Openeye Name: 5-(4-aminobutyl)-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol CAS Name: 5-(4-aminobutyl)-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-ol IUPAC Name: 5-(4-aminobutyl)-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol Traditional Name: 5-(4-aminobutyl)-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol Formula: C32H57NO2 MolecularWeight: 487.80048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)CCCCN)O

Isomeric SMILES

CC1=C(C(=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)CCCCN)O

InChI

InChI=1S/C32H57NO2/c1-23(2)13-10-14-24(3)15-11-16-25(4)17-12-20-32(7)21-19-29-28(18-8-9-22-33)30(34)26(5)27(6)31(29)35-32/h23-25,34H,8-22,33H2,1-7H3