3-methoxypropyl-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]azanium

Systemtic Name: 3-methoxypropyl-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]azanium Openeye Name: [2-[benzyl(2-thienylmethyl)amino]-2-oxo-ethyl]-(3-methoxypropyl)ammonium CAS Name: 3-methoxypropyl-[2-oxo-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]ammonium IUPAC Name: [2-[benzyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-(3-methoxypropyl)azanium Traditional Name: [2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-(3-methoxypropyl)ammonium Formula: C18H25N2O2S+ MolecularWeight: 333.4683

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH2+]CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2

Isomeric SMILES

COCCC[NH2+]CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2

InChI

InChI=1S/C18H24N2O2S/c1-22-11-6-10-19-13-18(21)20(15-17-9-5-12-23-17)14-16-7-3-2-4-8-16/h2-5,7-9,12,19H,6,10-11,13-15H2,1H3/p+1