[(2S)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-(2-azanyl-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-(2-azanyl-2-oxidanylidene-ethoxy)benzoate Openeye Name: [(1S)-2-(allylamino)-1-methyl-2-oxo-ethyl] 4-(2-amino-2-oxo-ethoxy)benzoate CAS Name: 4-(2-amino-2-oxoethoxy)benzoic acid [(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 4-(2-amino-2-oxoethoxy)benzoate Traditional Name: 4-(2-amino-2-keto-ethoxy)benzoic acid [(1S)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=CC=C(C=C1)OCC(=O)N

Isomeric SMILES

C[C@@H](C(=O)NCC=C)OC(=O)C1=CC=C(C=C1)OCC(=O)N

InChI

InChI=1S/C15H18N2O5/c1-3-8-17-14(19)10(2)22-15(20)11-4-6-12(7-5-11)21-9-13(16)18/h3-7,10H,1,8-9H2,2H3,(H2,16,18)(H,17,19)/t10-/m0/s1