[(2S)-1-[(2,5-diethoxy-4-morpholin-4-yl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 1H-indazole-3-carboxylate

Systemtic Name: [(2S)-1-[(2,5-diethoxy-4-morpholin-4-yl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 1H-indazole-3-carboxylate Openeye Name: [(1S)-2-(2,5-diethoxy-4-morpholino-anilino)-1-methyl-2-oxo-ethyl] 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [(2S)-1-[2,5-diethoxy-4-(4-morpholinyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2,5-diethoxy-4-morpholin-4-ylanilino)-1-oxopropan-2-yl] 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [(1S)-2-(2,5-diethoxy-4-morpholino-anilino)-2-keto-1-methyl-ethyl] ester Formula: C25H30N4O6 MolecularWeight: 482.5289

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC(=O)C(C)OC(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC(=O)[C@H](C)OC(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C25H30N4O6/c1-4-33-21-15-20(29-10-12-32-13-11-29)22(34-5-2)14-19(21)26-24(30)16(3)35-25(31)23-17-8-6-7-9-18(17)27-28-23/h6-9,14-16H,4-5,10-13H2,1-3H3,(H,26,30)(H,27,28)/t16-/m0/s1