dicyclohexyl-[(1E,3E)-4-ethoxycarbonyl-5-oxidanylidene-hexa-1,3-dienyl]azanium

Systemtic Name: dicyclohexyl-[(1E,3E)-4-ethoxycarbonyl-5-oxidanylidene-hexa-1,3-dienyl]azanium Openeye Name: dicyclohexyl-[(1E,3E)-4-ethoxycarbonyl-5-oxo-hexa-1,3-dienyl]ammonium CAS Name: dicyclohexyl-[(1E,3E)-4-ethoxycarbonyl-5-oxohexa-1,3-dienyl]ammonium IUPAC Name: dicyclohexyl-[(1E,3E)-4-ethoxycarbonyl-5-oxohexa-1,3-dienyl]azanium Traditional Name: [(1E,3E)-4-carbethoxy-5-keto-hexa-1,3-dienyl]-dicyclohexyl-ammonium Formula: C21H34NO3+ MolecularWeight: 348.49956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC=C[NH+](C1CCCCC1)C2CCCCC2)C(=O)C

Isomeric SMILES

CCOC(=O)/C(=C/C=C/[NH+](C1CCCCC1)C2CCCCC2)/C(=O)C

InChI

InChI=1S/C21H33NO3/c1-3-25-21(24)20(17(2)23)15-10-16-22(18-11-6-4-7-12-18)19-13-8-5-9-14-19/h10,15-16,18-19H,3-9,11-14H2,1-2H3/p+1/b16-10+,20-15+