1-[2-methoxy-5-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-phenyl]piperazine

Systemtic Name: 1-[2-methoxy-5-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-phenyl]piperazine Openeye Name: 1-[5-[(4-benzyl-1-piperidyl)sulfonyl]-2-methoxy-phenyl]piperazine CAS Name: 1-[2-methoxy-5-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]phenyl]piperazine IUPAC Name: 1-[5-(4-benzylpiperidin-1-yl)sulfonyl-2-methoxyphenyl]piperazine Traditional Name: 1-[5-(4-benzylpiperidino)sulfonyl-2-methoxy-phenyl]piperazine Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)N4CCNCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)N4CCNCC4

InChI

InChI=1S/C23H31N3O3S/c1-29-23-8-7-21(18-22(23)25-15-11-24-12-16-25)30(27,28)26-13-9-20(10-14-26)17-19-5-3-2-4-6-19/h2-8,18,20,24H,9-17H2,1H3