N-[3-[2,3-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-bromanyl-1-oxidanyl-naphthalene-2-carboxamide

Systemtic Name: N-[3-[2,3-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-bromanyl-1-oxidanyl-naphthalene-2-carboxamide Openeye Name: N-[3-[2,3-bis(1,1-dimethylpropyl)phenoxy]butyl]-4-bromo-1-hydroxy-naphthalene-2-carboxamide CAS Name: N-[3-[2,3-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-bromo-1-hydroxy-2-naphthalenecarboxamide IUPAC Name: N-[3-[2,3-bis(2-methylbutan-2-yl)phenoxy]butyl]-4-bromo-1-hydroxynaphthalene-2-carboxamide Traditional Name: 4-bromo-N-[3-(2,3-ditert-amylphenoxy)butyl]-1-hydroxy-2-naphthamide Formula: C31H40BrNO3 MolecularWeight: 554.5582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=C(C(=CC=C1)OC(C)CCNC(=O)C2=C(C3=CC=CC=C3C(=C2)Br)O)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=C(C(=CC=C1)OC(C)CCNC(=O)C2=C(C3=CC=CC=C3C(=C2)Br)O)C(C)(C)CC

InChI

InChI=1S/C31H40BrNO3/c1-8-30(4,5)24-15-12-16-26(27(24)31(6,7)9-2)36-20(3)17-18-33-29(35)23-19-25(32)21-13-10-11-14-22(21)28(23)34/h10-16,19-20,34H,8-9,17-18H2,1-7H3,(H,33,35)