1-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-(hydroxymethyl)-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazin-2-one

Systemtic Name: 1-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-(hydroxymethyl)-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazin-2-one Openeye Name: 1-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-(hydroxymethyl)-1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one CAS Name: 1-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-(hydroxymethyl)-1-pyridin-4-yl-4-piperidinyl]methyl]-2-piperazinone IUPAC Name: 1-[[4-(6-chloronaphthalen-2-yl)sulfonyl-2-(hydroxymethyl)-1-pyridin-4-ylpiperidin-4-yl]methyl]piperazin-2-one Traditional Name: 1-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-methylol-1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one Formula: C26H29ClN4O4S MolecularWeight: 529.05086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1(CN2CCNCC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)CO)C5=CC=NC=C5

Isomeric SMILES

C1CN(C(CC1(CN2CCNCC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)CO)C5=CC=NC=C5

InChI

InChI=1S/C26H29ClN4O4S/c27-21-3-1-20-14-24(4-2-19(20)13-21)36(34,35)26(18-30-12-10-29-16-25(30)33)7-11-31(23(15-26)17-32)22-5-8-28-9-6-22/h1-6,8-9,13-14,23,29,32H,7,10-12,15-18H2