[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 2-(butylamino)benzoate

Systemtic Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 2-(butylamino)benzoate Openeye Name: [2-[[(1R)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 2-(butylamino)benzoate CAS Name: 2-(butylamino)benzoic acid [2-[[[[(2R)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] 2-(butylamino)benzoate Traditional Name: 2-(butylamino)benzoic acid [2-keto-2-[[(1R)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=CC=C1C(=O)OCC(=O)NC(=O)NC(C)CC

Isomeric SMILES

CCCCNC1=CC=CC=C1C(=O)OCC(=O)NC(=O)N[C@H](C)CC

InChI

InChI=1S/C18H27N3O4/c1-4-6-11-19-15-10-8-7-9-14(15)17(23)25-12-16(22)21-18(24)20-13(3)5-2/h7-10,13,19H,4-6,11-12H2,1-3H3,(H2,20,21,22,24)/t13-/m1/s1