diethyl 2-[6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxyhexanoylamino]pentanedioate

Systemtic Name: diethyl 2-[6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxyhexanoylamino]pentanedioate Openeye Name: diethyl 2-[6-[[6-(1,3-benzoxazol-2-yl)-2-naphthyl]oxy]hexanoylamino]pentanedioate CAS Name: 2-[[6-[[6-(1,3-benzoxazol-2-yl)-2-naphthalenyl]oxy]-1-oxohexyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]oxyhexanoylamino]pentanedioate Traditional Name: 2-[6-[6-(1,3-benzoxazol-2-yl)-2-naphthoxy]hexanoylamino]glutaric acid diethyl ester Formula: C32H36N2O7 MolecularWeight: 560.63744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)CCCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)CCCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C32H36N2O7/c1-3-38-30(36)18-17-27(32(37)39-4-2)33-29(35)12-6-5-9-19-40-25-16-15-22-20-24(14-13-23(22)21-25)31-34-26-10-7-8-11-28(26)41-31/h7-8,10-11,13-16,20-21,27H,3-6,9,12,17-19H2,1-2H3,(H,33,35)