[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 4-(morpholin-4-ium-4-ylmethyl)benzoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 4-(morpholin-4-ium-4-ylmethyl)benzoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 4-(morpholin-4-ium-4-ylmethyl)benzoate CAS Name: 4-(4-morpholin-4-iumylmethyl)benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 4-(morpholin-4-ium-4-ylmethyl)benzoate Traditional Name: 4-(morpholin-4-ium-4-ylmethyl)benzoic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C19H23N2O5+ MolecularWeight: 359.39632

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)C(=O)OCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)C(=O)OCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C19H22N2O5/c22-18(20-12-17-2-1-9-25-17)14-26-19(23)16-5-3-15(4-6-16)13-21-7-10-24-11-8-21/h1-6,9H,7-8,10-14H2,(H,20,22)/p+1