(2R)-4-[(4-ethanoylphenyl)amino]-2-morpholin-4-ium-4-yl-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-[(4-ethanoylphenyl)amino]-2-morpholin-4-ium-4-yl-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(4-acetylanilino)-2-morpholin-4-ium-4-yl-4-oxo-butanoate CAS Name: (2R)-4-(4-acetylanilino)-2-(4-morpholin-4-iumyl)-4-oxobutanoate IUPAC Name: (2R)-4-(4-acetylanilino)-2-morpholin-4-ium-4-yl-4-oxobutanoate Traditional Name: (2R)-4-(4-acetylanilino)-4-keto-2-morpholin-4-ium-4-yl-butyrate Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CC(C(=O)[O-])[NH+]2CCOCC2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)C[C@H](C(=O)[O-])[NH+]2CCOCC2

InChI

InChI=1S/C16H20N2O5/c1-11(19)12-2-4-13(5-3-12)17-15(20)10-14(16(21)22)18-6-8-23-9-7-18/h2-5,14H,6-10H2,1H3,(H,17,20)(H,21,22)/t14-/m1/s1