ethyl 4-[4-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]butanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[2-(4-chloro-2-methylphenoxy)-1-oxopropyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-(4-chloro-2-methylphenoxy)propanoylamino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C22H32ClN3O5 MolecularWeight: 453.95958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C(C)OC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C(C)OC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C22H32ClN3O5/c1-4-30-22(29)26-12-9-18(10-13-26)25-20(27)6-5-11-24-21(28)16(3)31-19-8-7-17(23)14-15(19)2/h7-8,14,16,18H,4-6,9-13H2,1-3H3,(H,24,28)(H,25,27)