4-[[4-(2,6-dimethylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[4-(2,6-dimethylphenoxy)phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[4-(2,6-dimethylphenoxy)anilino]-4-oxo-butanoate CAS Name: 4-[4-(2,6-dimethylphenoxy)anilino]-4-oxobutanoate IUPAC Name: 4-[4-(2,6-dimethylphenoxy)anilino]-4-oxobutanoate Traditional Name: 4-[4-(2,6-dimethylphenoxy)anilino]-4-keto-butyrate Formula: C18H18NO4- MolecularWeight: 312.33982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=CC=C(C=C2)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=CC=C(C=C2)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H19NO4/c1-12-4-3-5-13(2)18(12)23-15-8-6-14(7-9-15)19-16(20)10-11-17(21)22/h3-9H,10-11H2,1-2H3,(H,19,20)(H,21,22)/p-1