3-methylbutyl 4-[(2-chloranyl-5-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: 3-methylbutyl 4-[(2-chloranyl-5-nitro-phenyl)carbonylamino]benzoate Openeye Name: isopentyl 4-[(2-chloro-5-nitro-benzoyl)amino]benzoate CAS Name: 4-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[(2-chloro-5-nitrobenzoyl)amino]benzoate Traditional Name: 4-[(2-chloro-5-nitro-benzoyl)amino]benzoic acid isoamyl ester Formula: C19H19ClN2O5 MolecularWeight: 390.81756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H19ClN2O5/c1-12(2)9-10-27-19(24)13-3-5-14(6-4-13)21-18(23)16-11-15(22(25)26)7-8-17(16)20/h3-8,11-12H,9-10H2,1-2H3,(H,21,23)