ethyl 4-[(2-piperidin-1-ylsulfonylphenyl)methylcarbamoylamino]benzoate

Systemtic Name: ethyl 4-[(2-piperidin-1-ylsulfonylphenyl)methylcarbamoylamino]benzoate Openeye Name: ethyl 4-[[2-(1-piperidylsulfonyl)phenyl]methylcarbamoylamino]benzoate CAS Name: 4-[[oxo-[[2-(1-piperidinylsulfonyl)phenyl]methylamino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-piperidin-1-ylsulfonylphenyl)methylcarbamoylamino]benzoate Traditional Name: 4-[(2-piperidinosulfonylbenzyl)carbamoylamino]benzoic acid ethyl ester Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27N3O5S/c1-2-30-21(26)17-10-12-19(13-11-17)24-22(27)23-16-18-8-4-5-9-20(18)31(28,29)25-14-6-3-7-15-25/h4-5,8-13H,2-3,6-7,14-16H2,1H3,(H2,23,24,27)