ethyl 4-[2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(4-chloro-2-methylphenoxy)butanoylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H30ClN3O5 MolecularWeight: 487.9758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C25H30ClN3O5/c1-3-33-25(32)29-14-12-28(13-15-29)24(31)20-7-4-5-8-21(20)27-23(30)9-6-16-34-22-11-10-19(26)17-18(22)2/h4-5,7-8,10-11,17H,3,6,9,12-16H2,1-2H3,(H,27,30)