5-[bis(2-chloroethyl)aminomethyl]-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol

Systemtic Name: 5-[bis(2-chloroethyl)aminomethyl]-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol Openeye Name: 5-[bis(2-chloroethyl)aminomethyl]-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol CAS Name: 5-[bis(2-chloroethyl)aminomethyl]-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-ol IUPAC Name: 5-[bis(2-chloroethyl)aminomethyl]-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-ol Traditional Name: 5-[bis(2-chloroethyl)aminomethyl]-2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol Formula: C33H57Cl2NO2 MolecularWeight: 570.71718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)CN(CCCl)CCCl)O

Isomeric SMILES

CC1=C(C(=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)CN(CCCl)CCCl)O

InChI

InChI=1S/C33H57Cl2NO2/c1-24(2)11-8-12-25(3)13-9-14-26(4)15-10-17-33(7)18-16-29-30(23-36(21-19-34)22-20-35)31(37)27(5)28(6)32(29)38-33/h24-26,37H,8-23H2,1-7H3