1-(4-chloranyl-3-nitro-phenyl)sulfonyl-N-[(1R)-1-cyclopropylethyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)sulfonyl-N-[(1R)-1-cyclopropylethyl]piperidine-4-carboxamide Openeye Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-N-[(1R)-1-cyclopropylethyl]piperidine-4-carboxamide CAS Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-N-[(1R)-1-cyclopropylethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-N-[(1R)-1-cyclopropylethyl]piperidine-4-carboxamide Traditional Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-N-[(1R)-1-cyclopropylethyl]isonipecotamide Formula: C17H22ClN3O5S MolecularWeight: 415.89168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H22ClN3O5S/c1-11(12-2-3-12)19-17(22)13-6-8-20(9-7-13)27(25,26)14-4-5-15(18)16(10-14)21(23)24/h4-5,10-13H,2-3,6-9H2,1H3,(H,19,22)/t11-/m1/s1