[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3,5-diacetamidobenzoate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3,5-diacetamidobenzoate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 3,5-diacetamidobenzoate CAS Name: 3,5-diacetamidobenzoic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 3,5-diacetamidobenzoate Traditional Name: 3,5-diacetamidobenzoic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=CC(=CC(=C1)NC(=O)C)NC(=O)C

Isomeric SMILES

CC(C(=O)NCC=C)OC(=O)C1=CC(=CC(=C1)NC(=O)C)NC(=O)C

InChI

InChI=1S/C17H21N3O5/c1-5-6-18-16(23)10(2)25-17(24)13-7-14(19-11(3)21)9-15(8-13)20-12(4)22/h5,7-10H,1,6H2,2-4H3,(H,18,23)(H,19,21)(H,20,22)