[(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate Openeye Name: [(1R)-1-methyl-2-oxo-2-ureido-ethyl] (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]butanoic acid [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-1-oxopropan-2-yl] (2S)-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butyric acid [(1R)-2-keto-1-methyl-2-ureido-ethyl] ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)C(=O)NC(=O)N)NC(=O)CC1=CC=CC2=CC=CC=C21

Isomeric SMILES

C[C@H](C(=O)NC(=O)N)OC(=O)[C@H](C(C)C)NC(=O)CC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C21H25N3O5/c1-12(2)18(20(27)29-13(3)19(26)24-21(22)28)23-17(25)11-15-9-6-8-14-7-4-5-10-16(14)15/h4-10,12-13,18H,11H2,1-3H3,(H,23,25)(H3,22,24,26,28)/t13-,18+/m1/s1