5-(morpholin-4-ium-4-ylmethyl)-2-phenyl-furan-3-carboxylate

Systemtic Name: 5-(morpholin-4-ium-4-ylmethyl)-2-phenyl-furan-3-carboxylate Openeye Name: 5-(morpholin-4-ium-4-ylmethyl)-2-phenyl-furan-3-carboxylate CAS Name: 5-(4-morpholin-4-iumylmethyl)-2-phenyl-3-furancarboxylate IUPAC Name: 5-(morpholin-4-ium-4-ylmethyl)-2-phenylfuran-3-carboxylate Traditional Name: 5-(morpholin-4-ium-4-ylmethyl)-2-phenyl-3-furoate Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC(=C(O2)C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CC(=C(O2)C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C16H17NO4/c18-16(19)14-10-13(11-17-6-8-20-9-7-17)21-15(14)12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H,18,19)