methyl 1-[4-(2-ethylbutanoylamino)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[4-(2-ethylbutanoylamino)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[4-(2-ethylbutanoylamino)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-[(2-ethyl-1-oxobutyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(2-ethylbutanoylamino)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-(2-ethylbutanoylamino)benzoyl]isonipecotic acid methyl ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)OC

Isomeric SMILES

CCC(CC)C(=O)NC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)OC

InChI

InChI=1S/C20H28N2O4/c1-4-14(5-2)18(23)21-17-8-6-15(7-9-17)19(24)22-12-10-16(11-13-22)20(25)26-3/h6-9,14,16H,4-5,10-13H2,1-3H3,(H,21,23)