2-[[3-(4-ethoxyphenyl)-3-oxidanylidene-propyl]azaniumyl]propanoate

Systemtic Name: 2-[[3-(4-ethoxyphenyl)-3-oxidanylidene-propyl]azaniumyl]propanoate Openeye Name: 2-[[3-(4-ethoxyphenyl)-3-oxo-propyl]ammonio]propanoate CAS Name: 2-[[3-(4-ethoxyphenyl)-3-oxopropyl]ammonio]propanoate IUPAC Name: 2-[[3-(4-ethoxyphenyl)-3-oxopropyl]azaniumyl]propanoate Traditional Name: 2-[(3-keto-3-p-phenetyl-propyl)ammonio]propionate Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CC[NH2+]C(C)C(=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CC[NH2+]C(C)C(=O)[O-]

InChI

InChI=1S/C14H19NO4/c1-3-19-12-6-4-11(5-7-12)13(16)8-9-15-10(2)14(17)18/h4-7,10,15H,3,8-9H2,1-2H3,(H,17,18)