ethyl 1-[3-(2-ethylbutanoylamino)phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(2-ethylbutanoylamino)phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-(2-ethylbutanoylamino)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[3-[(2-ethyl-1-oxobutyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-ethylbutanoylamino)benzoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(2-ethylbutanoylamino)benzoyl]isonipecotic acid ethyl ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N2O4/c1-4-15(5-2)19(24)22-18-9-7-8-17(14-18)20(25)23-12-10-16(11-13-23)21(26)27-6-3/h7-9,14-16H,4-6,10-13H2,1-3H3,(H,22,24)