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

Systemtic Name: 1-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-(methoxymethyl)-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazin-2-one Openeye Name: 1-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-(methoxymethyl)-1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one CAS Name: 1-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-(methoxymethyl)-1-pyridin-4-yl-4-piperidinyl]methyl]-2-piperazinone IUPAC Name: 1-[[4-(6-chloronaphthalen-2-yl)sulfonyl-2-(methoxymethyl)-1-pyridin-4-ylpiperidin-4-yl]methyl]piperazin-2-one Traditional Name: 1-[[4-[(6-chloro-2-naphthyl)sulfonyl]-2-(methoxymethyl)-1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one Formula: C27H31ClN4O4S MolecularWeight: 543.07744

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CC(CCN1C2=CC=NC=C2)(CN3CCNCC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

COCC1CC(CCN1C2=CC=NC=C2)(CN3CCNCC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C27H31ClN4O4S/c1-36-18-24-16-27(19-31-13-11-30-17-26(31)33,8-12-32(24)23-6-9-29-10-7-23)37(34,35)25-5-3-20-14-22(28)4-2-21(20)15-25/h2-7,9-10,14-15,24,30H,8,11-13,16-19H2,1H3