N-(3-methoxyphenyl)-4-methylsulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(3-methoxyphenyl)-4-methylsulfonyl-piperazine-1-carboxamide Openeye Name: N-(3-methoxyphenyl)-4-methylsulfonyl-piperazine-1-carboxamide CAS Name: N-(3-methoxyphenyl)-4-methylsulfonyl-1-piperazinecarboxamide IUPAC Name: N-(3-methoxyphenyl)-4-methylsulfonylpiperazine-1-carboxamide Traditional Name: 4-mesyl-N-(3-methoxyphenyl)piperazine-1-carboxamide Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C13H19N3O4S/c1-20-12-5-3-4-11(10-12)14-13(17)15-6-8-16(9-7-15)21(2,18)19/h3-5,10H,6-9H2,1-2H3,(H,14,17)