1-[4-[4-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]phenoxy]butyl]piperidine-2-carboxylate

Systemtic Name: 1-[4-[4-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]phenoxy]butyl]piperidine-2-carboxylate Openeye Name: 1-[4-[4-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]phenoxy]butyl]piperidine-2-carboxylate CAS Name: 1-[4-[4-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]phenoxy]butyl]-2-piperidinecarboxylate IUPAC Name: 1-[4-[4-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrochromen-4-yl]phenoxy]butyl]piperidine-2-carboxylate Traditional Name: 1-[4-[4-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]phenoxy]butyl]pipecolinate Formula: C32H36NO6- MolecularWeight: 530.63134

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C1C3=CC=C(C=C3)OCCCCN4CCCCC4C(=O)[O-])C=CC(=C2)O)C5=CC=C(C=C5)O

Isomeric SMILES

CC1(COC2=C(C1C3=CC=C(C=C3)OCCCCN4CCCCC4C(=O)[O-])C=CC(=C2)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C32H37NO6/c1-32(23-9-11-24(34)12-10-23)21-39-29-20-25(35)13-16-27(29)30(32)22-7-14-26(15-8-22)38-19-5-4-18-33-17-3-2-6-28(33)31(36)37/h7-16,20,28,30,34-35H,2-6,17-19,21H2,1H3,(H,36,37)/p-1