4-oxidanylidene-4-[(4-phenyloxan-4-yl)methylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[(4-phenyloxan-4-yl)methylamino]butanoic acid Openeye Name: 4-oxo-4-[(4-phenyltetrahydropyran-4-yl)methylamino]butanoic acid CAS Name: 4-oxo-4-[(4-phenyl-4-oxanyl)methylamino]butanoic acid IUPAC Name: 4-oxo-4-[(4-phenyloxan-4-yl)methylamino]butanoic acid Traditional Name: 4-keto-4-[(4-phenyltetrahydropyran-4-yl)methylamino]butyric acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(CNC(=O)CCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

C1COCCC1(CNC(=O)CCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H21NO4/c18-14(6-7-15(19)20)17-12-16(8-10-21-11-9-16)13-4-2-1-3-5-13/h1-5H,6-12H2,(H,17,18)(H,19,20)