cyclohexylazanium; 1-[(E)-2-(2-methoxyethoxymethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-prop-1-enyl]cyclopentane-1-carboxylate

Systemtic Name: cyclohexylazanium; 1-[(E)-2-(2-methoxyethoxymethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-prop-1-enyl]cyclopentane-1-carboxylate Openeye Name: 1-[(E)-3-tert-butoxy-2-(2-methoxyethoxymethyl)-3-oxo-prop-1-enyl]cyclopentanecarboxylate; cyclohexylammonium CAS Name: cyclohexylammonium; 1-[(E)-2-(2-methoxyethoxymethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]-1-cyclopentanecarboxylate IUPAC Name: cyclohexylazanium; 1-[(E)-2-(2-methoxyethoxymethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]cyclopentane-1-carboxylate Traditional Name: 1-[(E)-3-tert-butoxy-3-keto-2-(2-methoxyethoxymethyl)prop-1-enyl]cyclopentanecarboxylate; cyclohexylammonium Formula: C23H41NO6 MolecularWeight: 427.57474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=CC1(CCCC1)C(=O)[O-])COCCOC.C1CCC(CC1)[NH3+]

Isomeric SMILES

CC(C)(C)OC(=O)/C(=C/C1(CCCC1)C(=O)[O-])/COCCOC.C1CCC(CC1)[NH3+]

InChI

InChI=1S/C17H28O6.C6H13N/c1-16(2,3)23-14(18)13(12-22-10-9-21-4)11-17(15(19)20)7-5-6-8-17;7-6-4-2-1-3-5-6/h11H,5-10,12H2,1-4H3,(H,19,20);6H,1-5,7H2/b13-11+;