N-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-1-(3,4-dichlorophenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-1-(3,4-dichlorophenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)phenyl]-1-(3,4-dichlorobenzoyl)piperidine-3-carboxamide CAS Name: N-[4-(2-amino-2-oxoethyl)phenyl]-1-[(3,4-dichlorophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)phenyl]-1-(3,4-dichlorobenzoyl)piperidine-3-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)phenyl]-1-(3,4-dichlorobenzoyl)nipecotamide Formula: C21H21Cl2N3O3 MolecularWeight: 434.31574

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=CC=C(C=C3)CC(=O)N

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=CC=C(C=C3)CC(=O)N

InChI

InChI=1S/C21H21Cl2N3O3/c22-17-8-5-14(11-18(17)23)21(29)26-9-1-2-15(12-26)20(28)25-16-6-3-13(4-7-16)10-19(24)27/h3-8,11,15H,1-2,9-10,12H2,(H2,24,27)(H,25,28)