ethyl 4-[4-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]butanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[(3-bromo-4-methoxy-benzoyl)amino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[(3-bromo-4-methoxyphenyl)-oxomethyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-bromo-4-methoxybenzoyl)amino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[(3-bromo-4-methoxy-benzoyl)amino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C20H28BrN3O5 MolecularWeight: 470.35742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C20H28BrN3O5/c1-3-29-20(27)24-11-8-15(9-12-24)23-18(25)5-4-10-22-19(26)14-6-7-17(28-2)16(21)13-14/h6-7,13,15H,3-5,8-12H2,1-2H3,(H,22,26)(H,23,25)