1-[tert-butylcarbamoyl-(3-isocyanato-4-methyl-phenyl)amino]ethyl 2-methylprop-2-enoate

Systemtic Name: 1-[tert-butylcarbamoyl-(3-isocyanato-4-methyl-phenyl)amino]ethyl 2-methylprop-2-enoate Openeye Name: 1-[N-(tert-butylcarbamoyl)-3-isocyanato-4-methyl-anilino]ethyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 1-(N-[(tert-butylamino)-oxomethyl]-3-isocyanato-4-methylanilino)ethyl ester IUPAC Name: 1-[N-(tert-butylcarbamoyl)-3-isocyanato-4-methylanilino]ethyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 1-[N-(tert-butylcarbamoyl)-3-isocyanato-4-methyl-anilino]ethyl ester Formula: C19H25N3O4 MolecularWeight: 359.4195

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C(C)OC(=O)C(=C)C)C(=O)NC(C)(C)C)N=C=O

Isomeric SMILES

CC1=C(C=C(C=C1)N(C(C)OC(=O)C(=C)C)C(=O)NC(C)(C)C)N=C=O

InChI

InChI=1S/C19H25N3O4/c1-12(2)17(24)26-14(4)22(18(25)21-19(5,6)7)15-9-8-13(3)16(10-15)20-11-23/h8-10,14H,1H2,2-7H3,(H,21,25)