(3,3-dimethyl-2-oxidanylidene-butyl) 5-[[4-(2-methoxyphenoxy)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 5-[[4-(2-methoxyphenoxy)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 5-[4-(2-methoxyphenoxy)anilino]-5-oxo-pentanoate CAS Name: 5-[4-(2-methoxyphenoxy)anilino]-5-oxopentanoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 5-[4-(2-methoxyphenoxy)anilino]-5-oxopentanoate Traditional Name: 5-keto-5-[4-(2-methoxyphenoxy)anilino]valeric acid (2-keto-3,3-dimethyl-butyl) ester Formula: C24H29NO6 MolecularWeight: 427.49016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)CCCC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2OC

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)CCCC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2OC

InChI

InChI=1S/C24H29NO6/c1-24(2,3)21(26)16-30-23(28)11-7-10-22(27)25-17-12-14-18(15-13-17)31-20-9-6-5-8-19(20)29-4/h5-6,8-9,12-15H,7,10-11,16H2,1-4H3,(H,25,27)