[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] (3S)-3-phenylbutanoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] (3S)-3-phenylbutanoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] (3S)-3-phenylbutanoate CAS Name: (3S)-3-phenylbutanoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] (3S)-3-phenylbutanoate Traditional Name: (3S)-3-phenylbutyric acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)CC(C)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O4/c1-13(2)9-10-19-18(23)20-16(21)12-24-17(22)11-14(3)15-7-5-4-6-8-15/h4-8,13-14H,9-12H2,1-3H3,(H2,19,20,21,23)/t14-/m0/s1