(5-phenyl-1,3-oxazol-2-yl)methyl 3-nitro-4-[(phenylmethyl)amino]benzoate

Systemtic Name: (5-phenyl-1,3-oxazol-2-yl)methyl 3-nitro-4-[(phenylmethyl)amino]benzoate Openeye Name: (5-phenyloxazol-2-yl)methyl 4-(benzylamino)-3-nitro-benzoate CAS Name: 3-nitro-4-[(phenylmethyl)amino]benzoic acid (5-phenyl-2-oxazolyl)methyl ester IUPAC Name: (5-phenyl-1,3-oxazol-2-yl)methyl 4-(benzylamino)-3-nitrobenzoate Traditional Name: 4-(benzylamino)-3-nitro-benzoic acid (5-phenyloxazol-2-yl)methyl ester Formula: C24H19N3O5 MolecularWeight: 429.42476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)C(=O)OCC3=NC=C(O3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)C(=O)OCC3=NC=C(O3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H19N3O5/c28-24(31-16-23-26-15-22(32-23)18-9-5-2-6-10-18)19-11-12-20(21(13-19)27(29)30)25-14-17-7-3-1-4-8-17/h1-13,15,25H,14,16H2