ethyl 3-(3-bromanyl-4-cyclohexyl-5-nitro-phenyl)-2-chloranyl-propanoate

Systemtic Name: ethyl 3-(3-bromanyl-4-cyclohexyl-5-nitro-phenyl)-2-chloranyl-propanoate Openeye Name: ethyl 3-(3-bromo-4-cyclohexyl-5-nitro-phenyl)-2-chloro-propanoate CAS Name: 3-(3-bromo-4-cyclohexyl-5-nitrophenyl)-2-chloropropanoic acid ethyl ester IUPAC Name: ethyl 3-(3-bromo-4-cyclohexyl-5-nitrophenyl)-2-chloropropanoate Traditional Name: 3-(3-bromo-4-cyclohexyl-5-nitro-phenyl)-2-chloro-propionic acid ethyl ester Formula: C17H21BrClNO4 MolecularWeight: 418.70994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C(=C1)Br)C2CCCCC2)[N+](=O)[O-])Cl

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C(=C1)Br)C2CCCCC2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H21BrClNO4/c1-2-24-17(21)14(19)9-11-8-13(18)16(15(10-11)20(22)23)12-6-4-3-5-7-12/h8,10,12,14H,2-7,9H2,1H3