[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 4-ethylbenzoate

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 4-ethylbenzoate Openeye Name: [2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OCC(=O)NC(=O)NC(C)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OCC(=O)NC(=O)N[C@H](C)CC

InChI

InChI=1S/C16H22N2O4/c1-4-11(3)17-16(21)18-14(19)10-22-15(20)13-8-6-12(5-2)7-9-13/h6-9,11H,4-5,10H2,1-3H3,(H2,17,18,19,21)/t11-/m1/s1