2-[[3-ethoxy-4-(3-methylbutanoyloxy)phenyl]methylideneamino]benzoic acid

Systemtic Name: 2-[[3-ethoxy-4-(3-methylbutanoyloxy)phenyl]methylideneamino]benzoic acid Openeye Name: 2-[[3-ethoxy-4-(3-methylbutanoyloxy)phenyl]methyleneamino]benzoic acid CAS Name: 2-[[3-ethoxy-4-(3-methyl-1-oxobutoxy)phenyl]methylideneamino]benzoic acid IUPAC Name: 2-[[3-ethoxy-4-(3-methylbutanoyloxy)phenyl]methylideneamino]benzoic acid Traditional Name: 2-[(3-ethoxy-4-isovaleryloxy-benzylidene)amino]benzoic acid Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NC2=CC=CC=C2C(=O)O)OC(=O)CC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=NC2=CC=CC=C2C(=O)O)OC(=O)CC(C)C

InChI

InChI=1S/C21H23NO5/c1-4-26-19-12-15(9-10-18(19)27-20(23)11-14(2)3)13-22-17-8-6-5-7-16(17)21(24)25/h5-10,12-14H,4,11H2,1-3H3,(H,24,25)