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

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 4-butoxybenzoate Openeye Name: [2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C18H26N2O5 MolecularWeight: 350.40944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC(=O)NC(C)CC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)NC(=O)N[C@H](C)CC

InChI

InChI=1S/C18H26N2O5/c1-4-6-11-24-15-9-7-14(8-10-15)17(22)25-12-16(21)20-18(23)19-13(3)5-2/h7-10,13H,4-6,11-12H2,1-3H3,(H2,19,20,21,23)/t13-/m1/s1