[(1S,2S,3S)-1-carboxy-2-(4-chlorophenyl)-3-phenyl-cyclopropyl]azanium chloride

Systemtic Name: [(1S,2S,3S)-1-carboxy-2-(4-chlorophenyl)-3-phenyl-cyclopropyl]azanium chloride Openeye Name: [(1S,2S,3S)-1-carboxy-2-(4-chlorophenyl)-3-phenyl-cyclopropyl]ammonium chloride CAS Name: [(1S,2S,3S)-1-carboxy-2-(4-chlorophenyl)-3-phenylcyclopropyl]ammonium chloride IUPAC Name: [(1S,2S,3S)-1-carboxy-2-(4-chlorophenyl)-3-phenylcyclopropyl]azanium chloride Traditional Name: [(1S,2S,3S)-1-carboxy-2-(4-chlorophenyl)-3-phenyl-cyclopropyl]ammonium chloride Formula: C16H15Cl2NO2 MolecularWeight: 324.2018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C2(C(=O)O)[NH3+])C3=CC=C(C=C3)Cl.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2[C@H]([C@@]2(C(=O)O)[NH3+])C3=CC=C(C=C3)Cl.[Cl-]

InChI

InChI=1S/C16H14ClNO2.ClH/c17-12-8-6-11(7-9-12)14-13(16(14,18)15(19)20)10-4-2-1-3-5-10;/h1-9,13-14H,18H2,(H,19,20);1H/t13-,14-,16+;/m1./s1