[4-[(2-chloranyl-5-nitro-phenyl)carbonylamino]phenyl] (1S)-cyclohex-3-ene-1-carboxylate

Systemtic Name: [4-[(2-chloranyl-5-nitro-phenyl)carbonylamino]phenyl] (1S)-cyclohex-3-ene-1-carboxylate Openeye Name: [4-[(2-chloro-5-nitro-benzoyl)amino]phenyl] (1S)-cyclohex-3-ene-1-carboxylate CAS Name: (1S)-1-cyclohex-3-enecarboxylic acid [4-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(2-chloro-5-nitrobenzoyl)amino]phenyl] (1S)-cyclohex-3-ene-1-carboxylate Traditional Name: (1S)-cyclohex-3-ene-1-carboxylic acid [4-[(2-chloro-5-nitro-benzoyl)amino]phenyl] ester Formula: C20H17ClN2O5 MolecularWeight: 400.81238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)OC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)OC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H17ClN2O5/c21-18-11-8-15(23(26)27)12-17(18)19(24)22-14-6-9-16(10-7-14)28-20(25)13-4-2-1-3-5-13/h1-2,6-13H,3-5H2,(H,22,24)/t13-/m1/s1