4-chloranyl-2-nitro-N-[(2S)-2-phenylbutyl]benzamide

Systemtic Name: 4-chloranyl-2-nitro-N-[(2S)-2-phenylbutyl]benzamide Openeye Name: 4-chloro-2-nitro-N-[(2S)-2-phenylbutyl]benzamide CAS Name: 4-chloro-2-nitro-N-[(2S)-2-phenylbutyl]benzamide IUPAC Name: 4-chloro-2-nitro-N-[(2S)-2-phenylbutyl]benzamide Traditional Name: 4-chloro-2-nitro-N-[(2S)-2-phenylbutyl]benzamide Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CC[C@H](CNC(=O)C1=C(C=C(C=C1)Cl)[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C17H17ClN2O3/c1-2-12(13-6-4-3-5-7-13)11-19-17(21)15-9-8-14(18)10-16(15)20(22)23/h3-10,12H,2,11H2,1H3,(H,19,21)/t12-/m1/s1