N-[(2R)-2-acetamidocyclohexyl]-1-(3,4-dichlorophenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-[(2R)-2-acetamidocyclohexyl]-1-(3,4-dichlorophenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-[(2R)-2-acetamidocyclohexyl]-1-(3,4-dichlorobenzoyl)piperidine-3-carboxamide CAS Name: N-[(2R)-2-acetamidocyclohexyl]-1-[(3,4-dichlorophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[(2R)-2-acetamidocyclohexyl]-1-(3,4-dichlorobenzoyl)piperidine-3-carboxamide Traditional Name: N-[(2R)-2-acetamidocyclohexyl]-1-(3,4-dichlorobenzoyl)nipecotamide Formula: C21H27Cl2N3O3 MolecularWeight: 440.36338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCCCC1NC(=O)C2CCCN(C2)C(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)N[C@@H]1CCCCC1NC(=O)C2CCCN(C2)C(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H27Cl2N3O3/c1-13(27)24-18-6-2-3-7-19(18)25-20(28)15-5-4-10-26(12-15)21(29)14-8-9-16(22)17(23)11-14/h8-9,11,15,18-19H,2-7,10,12H2,1H3,(H,24,27)(H,25,28)/t15?,18-,19?/m1/s1