1-(1,3-benzodioxol-5-ylmethyl)-4-(4-chloranylnaphthalen-1-yl)sulfonyl-piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-chloranylnaphthalen-1-yl)sulfonyl-piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-chloro-1-naphthyl)sulfonyl]piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-chloro-1-naphthalenyl)sulfonyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-chloronaphthalen-1-yl)sulfonylpiperazine Traditional Name: 1-[(4-chloro-1-naphthyl)sulfonyl]-4-piperonyl-piperazine Formula: C22H21ClN2O4S MolecularWeight: 444.93114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C5=CC=CC=C54)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C5=CC=CC=C54)Cl

InChI

InChI=1S/C22H21ClN2O4S/c23-19-6-8-22(18-4-2-1-3-17(18)19)30(26,27)25-11-9-24(10-12-25)14-16-5-7-20-21(13-16)29-15-28-20/h1-8,13H,9-12,14-15H2