N-[2-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]ethyl]-2-nitro-benzamide hydrochloride

Systemtic Name: N-[2-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]ethyl]-2-nitro-benzamide hydrochloride Openeye Name: N-[2-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]ethyl]-2-nitro-benzamide hydrochloride CAS Name: N-[2-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]ethyl]-2-nitrobenzamide hydrochloride IUPAC Name: N-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]ethyl]-2-nitrobenzamide hydrochloride Traditional Name: N-[2-[4-(4-chlorophenyl)-4-hydroxy-piperidino]ethyl]-2-nitro-benzamide hydrochloride Formula: C20H23Cl2N3O4 MolecularWeight: 440.32032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCNC(=O)C3=CC=CC=C3[N+](=O)[O-].Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCNC(=O)C3=CC=CC=C3[N+](=O)[O-].Cl

InChI

InChI=1S/C20H22ClN3O4.ClH/c21-16-7-5-15(6-8-16)20(26)9-12-23(13-10-20)14-11-22-19(25)17-3-1-2-4-18(17)24(27)28;/h1-8,26H,9-14H2,(H,22,25);1H