tert-butyl 4-[(E)-3-[(2-methoxycarbonylphenyl)amino]-3-oxidanylidene-prop-1-enyl]imidazole-1-carboxylate

Systemtic Name: tert-butyl 4-[(E)-3-[(2-methoxycarbonylphenyl)amino]-3-oxidanylidene-prop-1-enyl]imidazole-1-carboxylate Openeye Name: tert-butyl 4-[(E)-3-(2-methoxycarbonylanilino)-3-oxo-prop-1-enyl]imidazole-1-carboxylate CAS Name: 4-[(E)-3-(2-methoxycarbonylanilino)-3-oxoprop-1-enyl]-1-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-3-(2-methoxycarbonylanilino)-3-oxoprop-1-enyl]imidazole-1-carboxylate Traditional Name: 4-[(E)-3-(2-carbomethoxyanilino)-3-keto-prop-1-enyl]imidazole-1-carboxylic acid tert-butyl ester Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(N=C1)C=CC(=O)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(N=C1)/C=C/C(=O)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C19H21N3O5/c1-19(2,3)27-18(25)22-11-13(20-12-22)9-10-16(23)21-15-8-6-5-7-14(15)17(24)26-4/h5-12H,1-4H3,(H,21,23)/b10-9+