4-[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-2-nitro-phenoxy]-1-oxidanyl-N-(2-tetradecoxyphenyl)naphthalene-2-carboxamide

Systemtic Name: 4-[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-2-nitro-phenoxy]-1-oxidanyl-N-(2-tetradecoxyphenyl)naphthalene-2-carboxamide Openeye Name: 4-[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-2-nitro-phenoxy]-1-hydroxy-N-(2-tetradecoxyphenyl)naphthalene-2-carboxamide CAS Name: 4-[4-[[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]methyl]-2-nitrophenoxy]-1-hydroxy-N-(2-tetradecoxyphenyl)-2-naphthalenecarboxamide IUPAC Name: 4-[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-2-nitrophenoxy]-1-hydroxy-N-(2-tetradecoxyphenyl)naphthalene-2-carboxamide Traditional Name: 4-[4-[[(5-ethyl-1,3,4-oxadiazol-2-yl)thio]methyl]-2-nitro-phenoxy]-1-hydroxy-N-(2-myristyloxyphenyl)-2-naphthamide Formula: C42H50N4O7S MolecularWeight: 754.934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=C(C=C(C=C4)CSC5=NN=C(O5)CC)[N+](=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC=C1NC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=C(C=C(C=C4)CSC5=NN=C(O5)CC)[N+](=O)[O-])O

InChI

InChI=1S/C42H50N4O7S/c1-3-5-6-7-8-9-10-11-12-13-14-19-26-51-36-23-18-17-22-34(36)43-41(48)33-28-38(31-20-15-16-21-32(31)40(33)47)52-37-25-24-30(27-35(37)46(49)50)29-54-42-45-44-39(4-2)53-42/h15-18,20-25,27-28,47H,3-14,19,26,29H2,1-2H3,(H,43,48)