[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: [2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [2-(isobutylcarbamoylamino)-2-oxo-ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid [2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylcarbamoylamino)-2-oxoethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [2-(isobutylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H29N3O5 MolecularWeight: 391.46136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)COC(=O)C(C(C)C)NC(=O)CC1=CC=CC=C1

Isomeric SMILES

CC(C)CNC(=O)NC(=O)COC(=O)[C@H](C(C)C)NC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C20H29N3O5/c1-13(2)11-21-20(27)23-17(25)12-28-19(26)18(14(3)4)22-16(24)10-15-8-6-5-7-9-15/h5-9,13-14,18H,10-12H2,1-4H3,(H,22,24)(H2,21,23,25,27)/t18-/m0/s1