3-(4-nitrophenyl)-2-(piperidin-1-ium-1-ylmethylimino)-1,3-thiazolidin-4-one

Systemtic Name: 3-(4-nitrophenyl)-2-(piperidin-1-ium-1-ylmethylimino)-1,3-thiazolidin-4-one Openeye Name: 3-(4-nitrophenyl)-2-(piperidin-1-ium-1-ylmethylimino)thiazolidin-4-one CAS Name: 3-(4-nitrophenyl)-2-(1-piperidin-1-iumylmethylimino)-4-thiazolidinone IUPAC Name: 3-(4-nitrophenyl)-2-(piperidin-1-ium-1-ylmethylimino)-1,3-thiazolidin-4-one Traditional Name: 3-(4-nitrophenyl)-2-(piperidin-1-ium-1-ylmethylimino)thiazolidin-4-one Formula: C15H19N4O3S+ MolecularWeight: 335.40136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN=C2N(C(=O)CS2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CN=C2N(C(=O)CS2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O3S/c20-14-10-23-15(16-11-17-8-2-1-3-9-17)18(14)12-4-6-13(7-5-12)19(21)22/h4-7H,1-3,8-11H2/p+1