3-ethoxycarbonyl-1,4-dihexoxy-naphthalene-2-carboxylate

Systemtic Name: 3-ethoxycarbonyl-1,4-dihexoxy-naphthalene-2-carboxylate Openeye Name: 3-ethoxycarbonyl-1,4-dihexoxy-naphthalene-2-carboxylate CAS Name: 3-ethoxycarbonyl-1,4-dihexoxy-2-naphthalenecarboxylate IUPAC Name: 3-ethoxycarbonyl-1,4-dihexoxynaphthalene-2-carboxylate Traditional Name: 3-carbethoxy-1,4-dihexoxy-2-naphthoate Formula: C26H35O6- MolecularWeight: 443.5525

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=C(C2=CC=CC=C21)OCCCCCC)C(=O)OCC)C(=O)[O-]

Isomeric SMILES

CCCCCCOC1=C(C(=C(C2=CC=CC=C21)OCCCCCC)C(=O)OCC)C(=O)[O-]

InChI

InChI=1S/C26H36O6/c1-4-7-9-13-17-31-23-19-15-11-12-16-20(19)24(32-18-14-10-8-5-2)22(21(23)25(27)28)26(29)30-6-3/h11-12,15-16H,4-10,13-14,17-18H2,1-3H3,(H,27,28)/p-1