[(E)-6-ethoxy-4-ethoxycarbonyl-6-oxidanyl-hex-5-en-2-ylidene]-ethyl-propan-2-yl-azanium

Systemtic Name: [(E)-6-ethoxy-4-ethoxycarbonyl-6-oxidanyl-hex-5-en-2-ylidene]-ethyl-propan-2-yl-azanium Openeye Name: [(E)-5-ethoxy-3-ethoxycarbonyl-5-hydroxy-1-methyl-pent-4-enylidene]-ethyl-isopropyl-ammonium CAS Name: [(E)-6-ethoxy-4-ethoxycarbonyl-6-hydroxyhex-5-en-2-ylidene]-ethyl-propan-2-ylammonium IUPAC Name: [(E)-6-ethoxy-4-ethoxycarbonyl-6-hydroxyhex-5-en-2-ylidene]-ethyl-propan-2-ylazanium Traditional Name: [(E)-3-carbethoxy-5-ethoxy-5-hydroxy-1-methyl-pent-4-enylidene]-ethyl-isopropyl-ammonium Formula: C16H30NO4+ MolecularWeight: 300.4137

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C(C)CC(C=C(O)OCC)C(=O)OCC)C(C)C

Isomeric SMILES

CC[N+](=C(C)CC(/C=C(\O)/OCC)C(=O)OCC)C(C)C

InChI

InChI=1S/C16H29NO4/c1-7-17(12(4)5)13(6)10-14(16(19)21-9-3)11-15(18)20-8-2/h11-12,14H,7-10H2,1-6H3/p+1/b15-11+,17-13?