ethyl 4-[[1-(4-chlorophenyl)carbonylpiperidin-3-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(4-chlorophenyl)carbonylpiperidin-3-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(4-chlorobenzoyl)piperidine-3-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-[(4-chlorophenyl)-oxomethyl]-3-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-chlorobenzoyl)piperidine-3-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(4-chlorobenzoyl)nipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H28ClN3O4 MolecularWeight: 421.91772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H28ClN3O4/c1-2-29-21(28)24-12-9-18(10-13-24)23-19(26)16-4-3-11-25(14-16)20(27)15-5-7-17(22)8-6-15/h5-8,16,18H,2-4,9-14H2,1H3,(H,23,26)