1-[4-(2-chloranylethanoylamino)-2-morpholin-4-ylsulfonyl-phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[4-(2-chloranylethanoylamino)-2-morpholin-4-ylsulfonyl-phenyl]piperidine-4-carboxamide Openeye Name: 1-[4-[(2-chloroacetyl)amino]-2-morpholinosulfonyl-phenyl]piperidine-4-carboxamide CAS Name: 1-[4-[(2-chloro-1-oxoethyl)amino]-2-(4-morpholinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-[(2-chloroacetyl)amino]-2-morpholin-4-ylsulfonylphenyl]piperidine-4-carboxamide Traditional Name: 1-[4-[(2-chloroacetyl)amino]-2-morpholinosulfonyl-phenyl]isonipecotamide Formula: C18H25ClN4O5S MolecularWeight: 444.9329

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C2=C(C=C(C=C2)NC(=O)CCl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C1CN(CCC1C(=O)N)C2=C(C=C(C=C2)NC(=O)CCl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H25ClN4O5S/c19-12-17(24)21-14-1-2-15(22-5-3-13(4-6-22)18(20)25)16(11-14)29(26,27)23-7-9-28-10-8-23/h1-2,11,13H,3-10,12H2,(H2,20,25)(H,21,24)