(2S)-4-morpholin-4-yl-4-oxidanylidene-2-[(phenylmethyl)azaniumyl]butanoate

Systemtic Name: (2S)-4-morpholin-4-yl-4-oxidanylidene-2-[(phenylmethyl)azaniumyl]butanoate Openeye Name: (2S)-2-(benzylammonio)-4-morpholino-4-oxo-butanoate CAS Name: (2S)-4-(4-morpholinyl)-4-oxo-2-[(phenylmethyl)ammonio]butanoate IUPAC Name: (2S)-2-(benzylazaniumyl)-4-morpholin-4-yl-4-oxobutanoate Traditional Name: (2S)-2-(benzylammonio)-4-keto-4-morpholino-butyrate Formula: C15H20N2O4 MolecularWeight: 292.3303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CC(C(=O)[O-])[NH2+]CC2=CC=CC=C2

Isomeric SMILES

C1COCCN1C(=O)C[C@@H](C(=O)[O-])[NH2+]CC2=CC=CC=C2

InChI

InChI=1S/C15H20N2O4/c18-14(17-6-8-21-9-7-17)10-13(15(19)20)16-11-12-4-2-1-3-5-12/h1-5,13,16H,6-11H2,(H,19,20)/t13-/m0/s1