tert-butyl 3-[[(7-methoxy-4-oxidanylidene-chromen-2-yl)carbonylamino]methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[(7-methoxy-4-oxidanylidene-chromen-2-yl)carbonylamino]methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[[(7-methoxy-4-oxo-chromene-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate CAS Name: 3-[[[(7-methoxy-4-oxo-1-benzopyran-2-yl)-oxomethyl]amino]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[(7-methoxy-4-oxochromene-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate Traditional Name: 3-[[(4-keto-7-methoxy-chromene-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)CNC(=O)C2=CC(=O)C3=C(O2)C=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)CNC(=O)C2=CC(=O)C3=C(O2)C=C(C=C3)OC

InChI

InChI=1S/C21H26N2O6/c1-21(2,3)29-20(26)23-8-7-13(12-23)11-22-19(25)18-10-16(24)15-6-5-14(27-4)9-17(15)28-18/h5-6,9-10,13H,7-8,11-12H2,1-4H3,(H,22,25)