ethyl 4-[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(4-ethoxyphenyl)sulfonyl-methyl-amino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(4-ethoxyphenyl)sulfonyl-methylamino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-ethoxyphenyl)sulfonyl-methylamino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[methyl(p-phenetylsulfonyl)amino]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H27N3O6S MolecularWeight: 413.48848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C18H27N3O6S/c1-4-26-15-6-8-16(9-7-15)28(24,25)19(3)14-17(22)20-10-12-21(13-11-20)18(23)27-5-2/h6-9H,4-5,10-14H2,1-3H3