[4-(4-nitrophenoxy)phenyl]methyl 4-methyl-3-(propanoylamino)benzoate

Systemtic Name: [4-(4-nitrophenoxy)phenyl]methyl 4-methyl-3-(propanoylamino)benzoate Openeye Name: [4-(4-nitrophenoxy)phenyl]methyl 4-methyl-3-(propanoylamino)benzoate CAS Name: 4-methyl-3-(1-oxopropylamino)benzoic acid [4-(4-nitrophenoxy)phenyl]methyl ester IUPAC Name: [4-(4-nitrophenoxy)phenyl]methyl 4-methyl-3-(propanoylamino)benzoate Traditional Name: 4-methyl-3-propionamido-benzoic acid [4-(4-nitrophenoxy)benzyl] ester Formula: C24H22N2O6 MolecularWeight: 434.44128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)OC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCC(=O)NC1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)OC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C24H22N2O6/c1-3-23(27)25-22-14-18(7-4-16(22)2)24(28)31-15-17-5-10-20(11-6-17)32-21-12-8-19(9-13-21)26(29)30/h4-14H,3,15H2,1-2H3,(H,25,27)