tert-butyl 2-[[1-(3-ethoxy-3-oxidanylidene-propanoyl)-2,3-dihydroindol-6-yl]amino]-4,5-dihydroimidazole-1-carboxylate

Systemtic Name: tert-butyl 2-[[1-(3-ethoxy-3-oxidanylidene-propanoyl)-2,3-dihydroindol-6-yl]amino]-4,5-dihydroimidazole-1-carboxylate Openeye Name: tert-butyl 2-[[1-(3-ethoxy-3-oxo-propanoyl)indolin-6-yl]amino]-4,5-dihydroimidazole-1-carboxylate CAS Name: 2-[[1-(3-ethoxy-1,3-dioxopropyl)-2,3-dihydroindol-6-yl]amino]-4,5-dihydroimidazole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[1-(3-ethoxy-3-oxopropanoyl)-2,3-dihydroindol-6-yl]amino]-4,5-dihydroimidazole-1-carboxylate Traditional Name: 2-[[1-(3-ethoxy-3-keto-propanoyl)indolin-6-yl]amino]-2-imidazoline-1-carboxylic acid tert-butyl ester Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)N1CCC2=C1C=C(C=C2)NC3=NCCN3C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CC(=O)N1CCC2=C1C=C(C=C2)NC3=NCCN3C(=O)OC(C)(C)C

InChI

InChI=1S/C21H28N4O5/c1-5-29-18(27)13-17(26)24-10-8-14-6-7-15(12-16(14)24)23-19-22-9-11-25(19)20(28)30-21(2,3)4/h6-7,12H,5,8-11,13H2,1-4H3,(H,22,23)