[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 2-phenethylbenzoate

Systemtic Name: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] 2-phenethylbenzoate Openeye Name: [2-(2,6-diethylanilino)-2-oxo-ethyl] 2-phenethylbenzoate CAS Name: 2-phenethylbenzoic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-diethylanilino)-2-oxoethyl] 2-phenethylbenzoate Traditional Name: 2-phenethylbenzoic acid [2-(2,6-diethylanilino)-2-keto-ethyl] ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C2=CC=CC=C2CCC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C2=CC=CC=C2CCC3=CC=CC=C3

InChI

InChI=1S/C27H29NO3/c1-3-21-14-10-15-22(4-2)26(21)28-25(29)19-31-27(30)24-16-9-8-13-23(24)18-17-20-11-6-5-7-12-20/h5-16H,3-4,17-19H2,1-2H3,(H,28,29)