4-(1-phenylethylamino)-3,6-dihydro-2H-pyran-5-carboxylic acid

Systemtic Name: 4-(1-phenylethylamino)-3,6-dihydro-2H-pyran-5-carboxylic acid Openeye Name: 4-(1-phenylethylamino)-3,6-dihydro-2H-pyran-5-carboxylic acid CAS Name: 4-(1-phenylethylamino)-3,6-dihydro-2H-pyran-5-carboxylic acid IUPAC Name: 4-(1-phenylethylamino)-3,6-dihydro-2H-pyran-5-carboxylic acid Traditional Name: 4-(1-phenylethylamino)-3,6-dihydro-2H-pyran-5-carboxylic acid Formula: C14H17NO3 MolecularWeight: 247.28968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=C(COCC2)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=C(COCC2)C(=O)O

InChI

InChI=1S/C14H17NO3/c1-10(11-5-3-2-4-6-11)15-13-7-8-18-9-12(13)14(16)17/h2-6,10,15H,7-9H2,1H3,(H,16,17)