2-ethoxyethylazanium; (E)-3-(1-oxidanylidene-2,4-diazaspiro[4.5]dec-3-en-3-yl)-2-propyl-pent-2-enoate

Systemtic Name: 2-ethoxyethylazanium; (E)-3-(1-oxidanylidene-2,4-diazaspiro[4.5]dec-3-en-3-yl)-2-propyl-pent-2-enoate Openeye Name: 2-ethoxyethylammonium; (E)-3-(1-oxo-2,4-diazaspiro[4.5]dec-3-en-3-yl)-2-propyl-pent-2-enoate CAS Name: 2-ethoxyethylammonium; (E)-3-(1-oxo-2,4-diazaspiro[4.5]dec-3-en-3-yl)-2-propyl-2-pentenoate IUPAC Name: 2-ethoxyethylazanium; (E)-3-(1-oxo-2,4-diazaspiro[4.5]dec-3-en-3-yl)-2-propylpent-2-enoate Traditional Name: 2-ethoxyethylammonium; (E)-3-(1-keto-2,4-diazaspiro[4.5]dec-3-en-3-yl)-2-propyl-pent-2-enoate Formula: C20H35N3O4 MolecularWeight: 381.5096

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C(CC)C1=NC2(CCCCC2)C(=O)N1)C(=O)[O-].CCOCC[NH3+]

Isomeric SMILES

CCC/C(=C(/CC)\C1=NC2(CCCCC2)C(=O)N1)/C(=O)[O-].CCOCC[NH3+]

InChI

InChI=1S/C16H24N2O3.C4H11NO/c1-3-8-12(14(19)20)11(4-2)13-17-15(21)16(18-13)9-6-5-7-10-16;1-2-6-4-3-5/h3-10H2,1-2H3,(H,19,20)(H,17,18,21);2-5H2,1H3/b12-11+;