(2S)-2-(4-chloranyl-2-nitro-phenoxy)-N-[2-(cyclohexen-1-yl)ethyl]propanamide

Systemtic Name: (2S)-2-(4-chloranyl-2-nitro-phenoxy)-N-[2-(cyclohexen-1-yl)ethyl]propanamide Openeye Name: (2S)-2-(4-chloro-2-nitro-phenoxy)-N-[2-(cyclohexen-1-yl)ethyl]propanamide CAS Name: (2S)-2-(4-chloro-2-nitrophenoxy)-N-[2-(1-cyclohexenyl)ethyl]propanamide IUPAC Name: (2S)-2-(4-chloro-2-nitrophenoxy)-N-[2-(cyclohexen-1-yl)ethyl]propanamide Traditional Name: (2S)-2-(4-chloro-2-nitro-phenoxy)-N-[2-(cyclohexen-1-yl)ethyl]propionamide Formula: C17H21ClN2O4 MolecularWeight: 352.81264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CCCCC1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CCCCC1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H21ClN2O4/c1-12(17(21)19-10-9-13-5-3-2-4-6-13)24-16-8-7-14(18)11-15(16)20(22)23/h5,7-8,11-12H,2-4,6,9-10H2,1H3,(H,19,21)/t12-/m0/s1