[(2S)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(phenylcarbamoylamino)propanoate

Systemtic Name: [(2S)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(phenylcarbamoylamino)propanoate Openeye Name: [(1S)-2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl] 3-(phenylcarbamoylamino)propanoate CAS Name: 3-[[anilino(oxo)methyl]amino]propanoic acid [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] 3-(phenylcarbamoylamino)propanoate Traditional Name: 3-(phenylcarbamoylamino)propionic acid [(1S)-2-keto-1-methyl-2-(o-phenetidino)ethyl] ester Formula: C21H25N3O5 MolecularWeight: 399.4403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)OC(=O)CCNC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C)OC(=O)CCNC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O5/c1-3-28-18-12-8-7-11-17(18)24-20(26)15(2)29-19(25)13-14-22-21(27)23-16-9-5-4-6-10-16/h4-12,15H,3,13-14H2,1-2H3,(H,24,26)(H2,22,23,27)/t15-/m0/s1