diethyl 2-[3-[5-(6-nitro-1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypropyl]propanedioate

Systemtic Name: diethyl 2-[3-[5-(6-nitro-1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypropyl]propanedioate Openeye Name: diethyl 2-[3-[[5-(6-nitro-1,3-benzoxazol-2-yl)-2-naphthyl]oxy]propyl]propanedioate CAS Name: 2-[3-[[5-(6-nitro-1,3-benzoxazol-2-yl)-2-naphthalenyl]oxy]propyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[3-[5-(6-nitro-1,3-benzoxazol-2-yl)naphthalen-2-yl]oxypropyl]propanedioate Traditional Name: 2-[3-[5-(6-nitro-1,3-benzoxazol-2-yl)-2-naphthoxy]propyl]malonic acid diethyl ester Formula: C27H26N2O8 MolecularWeight: 506.50394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCOC1=CC2=C(C=C1)C(=CC=C2)C3=NC4=C(O3)C=C(C=C4)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCCOC1=CC2=C(C=C1)C(=CC=C2)C3=NC4=C(O3)C=C(C=C4)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C27H26N2O8/c1-3-34-26(30)22(27(31)35-4-2)9-6-14-36-19-11-12-20-17(15-19)7-5-8-21(20)25-28-23-13-10-18(29(32)33)16-24(23)37-25/h5,7-8,10-13,15-16,22H,3-4,6,9,14H2,1-2H3