ethyl 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-benzoate

Systemtic Name: ethyl 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-benzoate Openeye Name: ethyl 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-benzoate CAS Name: 2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 2-ethoxy-5-(4-methylpiperazino)sulfonyl-benzoic acid ethyl ester Formula: C16H24N2O5S MolecularWeight: 356.43716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O5S/c1-4-22-15-7-6-13(12-14(15)16(19)23-5-2)24(20,21)18-10-8-17(3)9-11-18/h6-7,12H,4-5,8-11H2,1-3H3