1-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-(3,4-dimethoxyanilino)-2-keto-ethyl]cycloheptanecarboxylic acid Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CC2(CCCCCC2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CC2(CCCCCC2)C(=O)O)OC

InChI

InChI=1S/C18H25NO5/c1-23-14-8-7-13(11-15(14)24-2)19-16(20)12-18(17(21)22)9-5-3-4-6-10-18/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,19,20)(H,21,22)