[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(1,2-benzoxazol-3-yl)ethanoate

Systemtic Name: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(1,2-benzoxazol-3-yl)ethanoate Openeye Name: [2-(2,6-diethylanilino)-2-oxo-ethyl] 2-(1,2-benzoxazol-3-yl)acetate CAS Name: 2-(1,2-benzoxazol-3-yl)acetic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-diethylanilino)-2-oxoethyl] 2-(1,2-benzoxazol-3-yl)acetate Traditional Name: 2-indoxazen-3-ylacetic acid [2-(2,6-diethylanilino)-2-keto-ethyl] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)CC2=NOC3=CC=CC=C32

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)CC2=NOC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O4/c1-3-14-8-7-9-15(4-2)21(14)22-19(24)13-26-20(25)12-17-16-10-5-6-11-18(16)27-23-17/h5-11H,3-4,12-13H2,1-2H3,(H,22,24)