N-cyclopentyl-1-[[3-methyl-5-(2-morpholin-4-ium-4-ylethenyl)-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-cyclopentyl-1-[[3-methyl-5-(2-morpholin-4-ium-4-ylethenyl)-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxamide Openeye Name: N-cyclopentyl-1-[3-methyl-5-(2-morpholin-4-ium-4-ylvinyl)isoxazol-4-yl]sulfonyl-piperidine-3-carboxamide CAS Name: N-cyclopentyl-1-[[3-methyl-5-[2-(4-morpholin-4-iumyl)ethenyl]-4-isoxazolyl]sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-cyclopentyl-1-[[3-methyl-5-(2-morpholin-4-ium-4-ylethenyl)-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxamide Traditional Name: N-cyclopentyl-1-[3-methyl-5-(2-morpholin-4-ium-4-ylvinyl)isoxazol-4-yl]sulfonyl-nipecotamide Formula: C21H33N4O5S+ MolecularWeight: 453.57552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1S(=O)(=O)N2CCCC(C2)C(=O)NC3CCCC3)C=C[NH+]4CCOCC4

Isomeric SMILES

CC1=NOC(=C1S(=O)(=O)N2CCCC(C2)C(=O)NC3CCCC3)C=C[NH+]4CCOCC4

InChI

InChI=1S/C21H32N4O5S/c1-16-20(19(30-23-16)8-10-24-11-13-29-14-12-24)31(27,28)25-9-4-5-17(15-25)21(26)22-18-6-2-3-7-18/h8,10,17-18H,2-7,9,11-15H2,1H3,(H,22,26)/p+1