(2R)-4-(4-chlorophenyl)-4-oxidanylidene-2-(thiophen-2-ylmethylazaniumyl)butanoate

Systemtic Name: (2R)-4-(4-chlorophenyl)-4-oxidanylidene-2-(thiophen-2-ylmethylazaniumyl)butanoate Openeye Name: (2R)-4-(4-chlorophenyl)-4-oxo-2-(2-thienylmethylammonio)butanoate CAS Name: (2R)-4-(4-chlorophenyl)-4-oxo-2-(thiophen-2-ylmethylammonio)butanoate IUPAC Name: (2R)-4-(4-chlorophenyl)-4-oxo-2-(thiophen-2-ylmethylazaniumyl)butanoate Traditional Name: (2R)-4-(4-chlorophenyl)-4-keto-2-(2-thenylammonio)butyrate Formula: C15H14ClNO3S MolecularWeight: 323.79456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C[NH2+]C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C[NH2+][C@H](CC(=O)C2=CC=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C15H14ClNO3S/c16-11-5-3-10(4-6-11)14(18)8-13(15(19)20)17-9-12-2-1-7-21-12/h1-7,13,17H,8-9H2,(H,19,20)/t13-/m1/s1