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

Systemtic Name: (4-nitrophenyl)methyl 5-chloranyl-2-methoxy-4-(propanoylamino)benzoate Openeye Name: (4-nitrophenyl)methyl 5-chloro-2-methoxy-4-(propanoylamino)benzoate CAS Name: 5-chloro-2-methoxy-4-(1-oxopropylamino)benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 5-chloro-2-methoxy-4-(propanoylamino)benzoate Traditional Name: 5-chloro-2-methoxy-4-propionamido-benzoic acid (4-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=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

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