(2-nitrophenyl)methyl 5-chloranyl-2-methoxy-4-(propanoylamino)benzoate

Systemtic Name: (2-nitrophenyl)methyl 5-chloranyl-2-methoxy-4-(propanoylamino)benzoate Openeye Name: (2-nitrophenyl)methyl 5-chloro-2-methoxy-4-(propanoylamino)benzoate CAS Name: 5-chloro-2-methoxy-4-(1-oxopropylamino)benzoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 5-chloro-2-methoxy-4-(propanoylamino)benzoate Traditional Name: 5-chloro-2-methoxy-4-propionamido-benzoic acid (2-nitrobenzyl) ester Formula: C18H17ClN2O6 MolecularWeight: 392.79038

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C(=C1)OC)C(=O)OCC2=CC=CC=C2[N+](=O)[O-])Cl

Isomeric SMILES

CCC(=O)NC1=C(C=C(C(=C1)OC)C(=O)OCC2=CC=CC=C2[N+](=O)[O-])Cl

InChI

InChI=1S/C18H17ClN2O6/c1-3-17(22)20-14-9-16(26-2)12(8-13(14)19)18(23)27-10-11-6-4-5-7-15(11)21(24)25/h4-9H,3,10H2,1-2H3,(H,20,22)