3-phenyl-4-[4-(11-pyrrolidin-1-ylundecoxy)phenyl]-3,4-dihydro-2H-chromen-6-ol

Systemtic Name: 3-phenyl-4-[4-(11-pyrrolidin-1-ylundecoxy)phenyl]-3,4-dihydro-2H-chromen-6-ol Openeye Name: 3-phenyl-4-[4-(11-pyrrolidin-1-ylundecoxy)phenyl]chroman-6-ol CAS Name: 3-phenyl-4-[4-[11-(1-pyrrolidinyl)undecoxy]phenyl]-3,4-dihydro-2H-1-benzopyran-6-ol IUPAC Name: 3-phenyl-4-[4-(11-pyrrolidin-1-ylundecoxy)phenyl]-3,4-dihydro-2H-chromen-6-ol Traditional Name: 3-phenyl-4-[4-(11-pyrrolidinoundecoxy)phenyl]chroman-6-ol Formula: C36H47NO3 MolecularWeight: 541.76328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCCCCCCCCOC2=CC=C(C=C2)C3C(COC4=C3C=C(C=C4)O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)CCCCCCCCCCCOC2=CC=C(C=C2)C3C(COC4=C3C=C(C=C4)O)C5=CC=CC=C5

InChI

InChI=1S/C36H47NO3/c38-31-19-22-35-33(27-31)36(34(28-40-35)29-15-9-8-10-16-29)30-17-20-32(21-18-30)39-26-14-7-5-3-1-2-4-6-11-23-37-24-12-13-25-37/h8-10,15-22,27,34,36,38H,1-7,11-14,23-26,28H2