[1-oxidanylidene-1-(phenethylamino)propan-2-yl] 3-phenyl-2,1-benzoxazole-5-carboxylate

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] 3-phenyl-2,1-benzoxazole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] 3-phenyl-2,1-benzoxazole-5-carboxylate CAS Name: 3-phenyl-2,1-benzoxazole-5-carboxylic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] 3-phenyl-2,1-benzoxazole-5-carboxylate Traditional Name: 3-phenylanthranil-5-carboxylic acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4/c1-17(24(28)26-15-14-18-8-4-2-5-9-18)30-25(29)20-12-13-22-21(16-20)23(31-27-22)19-10-6-3-7-11-19/h2-13,16-17H,14-15H2,1H3,(H,26,28)