tert-butyl 2-[[2-[2,2-dimethylpropanoyl-(4-oxidanylidenechromen-5-yl)amino]phenyl]amino]-3-oxidanylidene-butanoate

Systemtic Name: tert-butyl 2-[[2-[2,2-dimethylpropanoyl-(4-oxidanylidenechromen-5-yl)amino]phenyl]amino]-3-oxidanylidene-butanoate Openeye Name: tert-butyl 2-[2-[2,2-dimethylpropanoyl-(4-oxochromen-5-yl)amino]anilino]-3-oxo-butanoate CAS Name: 2-[2-[(2,2-dimethyl-1-oxopropyl)-(4-oxo-1-benzopyran-5-yl)amino]anilino]-3-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-[2,2-dimethylpropanoyl-(4-oxochromen-5-yl)amino]anilino]-3-oxobutanoate Traditional Name: 3-keto-2-[2-[(4-ketochromen-5-yl)-pivaloyl-amino]anilino]butyric acid tert-butyl ester Formula: C28H32N2O6 MolecularWeight: 492.56348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)OC(C)(C)C)NC1=CC=CC=C1N(C2=C3C(=O)C=COC3=CC=C2)C(=O)C(C)(C)C

Isomeric SMILES

CC(=O)C(C(=O)OC(C)(C)C)NC1=CC=CC=C1N(C2=C3C(=O)C=COC3=CC=C2)C(=O)C(C)(C)C

InChI

InChI=1S/C28H32N2O6/c1-17(31)24(25(33)36-28(5,6)7)29-18-11-8-9-12-19(18)30(26(34)27(2,3)4)20-13-10-14-22-23(20)21(32)15-16-35-22/h8-16,24,29H,1-7H3