[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 3-phenyl-2,1-benzoxazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 3-phenyl-2,1-benzoxazole-5-carboxylate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 3-phenyl-2,1-benzoxazole-5-carboxylate CAS Name: 3-phenyl-2,1-benzoxazole-5-carboxylic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 3-phenyl-2,1-benzoxazole-5-carboxylate Traditional Name: 3-phenylanthranil-5-carboxylic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC2=C(ON=C2C=C1)C3=CC=CC=C3

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=CC2=C(ON=C2C=C1)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-3-7-14(2)22-19(24)13-26-21(25)16-10-11-18-17(12-16)20(27-23-18)15-8-5-4-6-9-15/h4-6,8-12,14H,3,7,13H2,1-2H3,(H,22,24)