N-(1-cyclopropylpiperidin-1-ium-4-yl)-4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxamide CAS Name: N-(1-cyclopropyl-4-piperidin-1-iumyl)-4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxamide Formula: C24H26FN2O2S+ MolecularWeight: 425.538843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+]2CCC(CC2)NC(=O)C3=C(C4=C(C=CC=C4S3)F)COC5=CC=CC=C5

Isomeric SMILES

C1CC1[NH+]2CCC(CC2)NC(=O)C3=C(C4=C(C=CC=C4S3)F)COC5=CC=CC=C5

InChI

InChI=1S/C24H25FN2O2S/c25-20-7-4-8-21-22(20)19(15-29-18-5-2-1-3-6-18)23(30-21)24(28)26-16-11-13-27(14-12-16)17-9-10-17/h1-8,16-17H,9-15H2,(H,26,28)/p+1