[4-(2-methoxyphenyl)piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-(2-methoxyphenyl)piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-(2-methoxyphenyl)piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [4-(2-methoxyphenyl)-1-piperazinyl]-[3-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: [4-(2-methoxyphenyl)piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-(2-methoxyphenyl)piperazino]-(3-pyrrolidinosulfonylphenyl)methanone Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H27N3O4S/c1-29-21-10-3-2-9-20(21)23-13-15-24(16-14-23)22(26)18-7-6-8-19(17-18)30(27,28)25-11-4-5-12-25/h2-3,6-10,17H,4-5,11-16H2,1H3