2-methylpropyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate

Systemtic Name: 2-methylpropyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: isobutyl 2-(4-chloro-3-nitro-benzoyl)benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(4-chloro-3-nitrobenzoyl)benzoate Traditional Name: 2-(4-chloro-3-nitro-benzoyl)benzoic acid isobutyl ester Formula: C18H16ClNO5 MolecularWeight: 361.77634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=CC=C1C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC(=O)C1=CC=CC=C1C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClNO5/c1-11(2)10-25-18(22)14-6-4-3-5-13(14)17(21)12-7-8-15(19)16(9-12)20(23)24/h3-9,11H,10H2,1-2H3