[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: [2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: [2-(3-acetamidoanilino)-2-oxo-ethyl] 3-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid [2-(3-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-acetamidoanilino)-2-oxoethyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)propionic acid [2-(3-acetamidoanilino)-2-keto-ethyl] ester Formula: C18H25N3O6 MolecularWeight: 379.4076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)COC(=O)CCNC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)COC(=O)CCNC(=O)OC(C)(C)C

InChI

InChI=1S/C18H25N3O6/c1-12(22)20-13-6-5-7-14(10-13)21-15(23)11-26-16(24)8-9-19-17(25)27-18(2,3)4/h5-7,10H,8-9,11H2,1-4H3,(H,19,25)(H,20,22)(H,21,23)