N-[2-(3-methoxyphenyl)phenyl]-1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[2-(3-methoxyphenyl)phenyl]-1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-[2-(3-methoxyphenyl)phenyl]-1-(2-thienylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-[2-(3-methoxyphenyl)phenyl]-1-(thiophen-2-ylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-[2-(3-methoxyphenyl)phenyl]-1-(thiophen-2-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-[2-(3-methoxyphenyl)phenyl]-1-(2-thenyl)piperidin-1-ium-4-carboxamide Formula: C24H27N2O2S+ MolecularWeight: 407.54838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC=CC=C2NC(=O)C3CC[NH+](CC3)CC4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC=CC=C2NC(=O)C3CC[NH+](CC3)CC4=CC=CS4

InChI

InChI=1S/C24H26N2O2S/c1-28-20-7-4-6-19(16-20)22-9-2-3-10-23(22)25-24(27)18-11-13-26(14-12-18)17-21-8-5-15-29-21/h2-10,15-16,18H,11-14,17H2,1H3,(H,25,27)/p+1