3-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-yl]oxy-N-phenethyl-benzamide

Systemtic Name: 3-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-yl]oxy-N-phenethyl-benzamide Openeye Name: 3-[1-[(2-methylthiazol-5-yl)methyl]piperidin-1-ium-4-yl]oxy-N-phenethyl-benzamide CAS Name: 3-[[1-[(2-methyl-5-thiazolyl)methyl]-4-piperidin-1-iumyl]oxy]-N-phenethylbenzamide IUPAC Name: 3-[1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-yl]oxy-N-phenethylbenzamide Traditional Name: 3-[1-[(2-methylthiazol-5-yl)methyl]piperidin-1-ium-4-yl]oxy-N-phenethyl-benzamide Formula: C25H30N3O2S+ MolecularWeight: 436.5896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(S1)C[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=NC=C(S1)C[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2S/c1-19-27-17-24(31-19)18-28-14-11-22(12-15-28)30-23-9-5-8-21(16-23)25(29)26-13-10-20-6-3-2-4-7-20/h2-9,16-17,22H,10-15,18H2,1H3,(H,26,29)/p+1