[3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl] 2-(2,4,6-trimethylphenoxy)ethanoate

Systemtic Name: [3-oxidanylidene-3-[(phenylmethyl)carbamoylamino]propyl] 2-(2,4,6-trimethylphenoxy)ethanoate Openeye Name: [3-(benzylcarbamoylamino)-3-oxo-propyl] 2-(2,4,6-trimethylphenoxy)acetate CAS Name: 2-(2,4,6-trimethylphenoxy)acetic acid [3-oxo-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propyl] ester IUPAC Name: [3-(benzylcarbamoylamino)-3-oxopropyl] 2-(2,4,6-trimethylphenoxy)acetate Traditional Name: 2-(2,4,6-trimethylphenoxy)acetic acid [3-(benzylcarbamoylamino)-3-keto-propyl] ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)OCCC(=O)NC(=O)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)OCCC(=O)NC(=O)NCC2=CC=CC=C2)C

InChI

InChI=1S/C22H26N2O5/c1-15-11-16(2)21(17(3)12-15)29-14-20(26)28-10-9-19(25)24-22(27)23-13-18-7-5-4-6-8-18/h4-8,11-12H,9-10,13-14H2,1-3H3,(H2,23,24,25,27)