[3-methoxy-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [3-methoxy-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [3-methoxy-4-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]methyl-(2-thienylmethyl)ammonium CAS Name: [3-methoxy-4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [3-methoxy-4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [4-(2-keto-2-piperidino-ethoxy)-3-methoxy-benzyl]-(2-thenyl)ammonium Formula: C20H27N2O3S+ MolecularWeight: 375.50498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CS2)OCC(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CS2)OCC(=O)N3CCCCC3

InChI

InChI=1S/C20H26N2O3S/c1-24-19-12-16(13-21-14-17-6-5-11-26-17)7-8-18(19)25-15-20(23)22-9-3-2-4-10-22/h5-8,11-12,21H,2-4,9-10,13-15H2,1H3/p+1