N'-butyl-11-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]undecanimidamide

Systemtic Name: N'-butyl-11-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]undecanimidamide Openeye Name: N'-butyl-11-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]undecanamidine CAS Name: N'-butyl-11-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]undecanimidamide IUPAC Name: N'-butyl-11-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrochromen-4-yl]undecanimidamide Traditional Name: N'-butyl-11-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]undecanamidine Formula: C31H46N2O3 MolecularWeight: 494.70854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(CCCCCCCCCCC1C2=C(C=C(C=C2)O)OCC1(C)C3=CC=C(C=C3)O)N

Isomeric SMILES

CCCCN=C(CCCCCCCCCCC1C2=C(C=C(C=C2)O)OCC1(C)C3=CC=C(C=C3)O)N

InChI

InChI=1S/C31H46N2O3/c1-3-4-21-33-30(32)14-12-10-8-6-5-7-9-11-13-28-27-20-19-26(35)22-29(27)36-23-31(28,2)24-15-17-25(34)18-16-24/h15-20,22,28,34-35H,3-14,21,23H2,1-2H3,(H2,32,33)