3-azabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; 1-[(2-methoxyphenyl)sulfonylmethyl]piperazine

Systemtic Name: 3-azabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; 1-[(2-methoxyphenyl)sulfonylmethyl]piperazine Openeye Name: 3-azabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; 1-[(2-methoxyphenyl)sulfonylmethyl]piperazine CAS Name: 3-azabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; 1-[(2-methoxyphenyl)sulfonylmethyl]piperazine IUPAC Name: 3-azabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; 1-[(2-methoxyphenyl)sulfonylmethyl]piperazine Traditional Name: 3-azabicyclo[2.2.2]octa-1(6),4,7-trien-2-one; 1-[(2-methoxyphenyl)sulfonylmethyl]piperazine Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1S(=O)(=O)CN2CCNCC2.C1=CC2=CC=C1C(=O)N2

Isomeric SMILES

COC1=CC=CC=C1S(=O)(=O)CN2CCNCC2.C1=CC2=CC=C1C(=O)N2

InChI

InChI=1S/C12H18N2O3S.C7H5NO/c1-17-11-4-2-3-5-12(11)18(15,16)10-14-8-6-13-7-9-14;9-7-5-1-3-6(8-7)4-2-5/h2-5,13H,6-10H2,1H3;1-4H,(H,8,9)