4-[[4-(2,5-dimethylphenoxy)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(2,5-dimethylphenoxy)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(2,5-dimethylphenoxy)anilino]-4-oxo-butanoic acid CAS Name: 4-[4-(2,5-dimethylphenoxy)anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-(2,5-dimethylphenoxy)anilino]-4-oxobutanoic acid Traditional Name: 4-[4-(2,5-dimethylphenoxy)anilino]-4-keto-butyric acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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