4-[3-[1-[(4-cyanophenyl)amino]-2-methoxy-2-oxidanylidene-ethyl]-5-ethoxy-phenoxy]piperidine-1-carboxylic acid

Systemtic Name: 4-[3-[1-[(4-cyanophenyl)amino]-2-methoxy-2-oxidanylidene-ethyl]-5-ethoxy-phenoxy]piperidine-1-carboxylic acid Openeye Name: 4-[3-[1-(4-cyanoanilino)-2-methoxy-2-oxo-ethyl]-5-ethoxy-phenoxy]piperidine-1-carboxylic acid CAS Name: 4-[3-[1-(4-cyanoanilino)-2-methoxy-2-oxoethyl]-5-ethoxyphenoxy]-1-piperidinecarboxylic acid IUPAC Name: 4-[3-[1-(4-cyanoanilino)-2-methoxy-2-oxoethyl]-5-ethoxyphenoxy]piperidine-1-carboxylic acid Traditional Name: 4-[3-[1-(4-cyanoanilino)-2-keto-2-methoxy-ethyl]-5-ethoxy-phenoxy]piperidine-1-carboxylic acid Formula: C24H27N3O6 MolecularWeight: 453.48768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)OC2CCN(CC2)C(=O)O)C(C(=O)OC)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC1=CC(=CC(=C1)OC2CCN(CC2)C(=O)O)C(C(=O)OC)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H27N3O6/c1-3-32-20-12-17(13-21(14-20)33-19-8-10-27(11-9-19)24(29)30)22(23(28)31-2)26-18-6-4-16(15-25)5-7-18/h4-7,12-14,19,22,26H,3,8-11H2,1-2H3,(H,29,30)