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

Systemtic Name: 3-ethoxypropyl-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]azanium Openeye Name: [2-[benzyl(2-thienylmethyl)amino]-2-oxo-ethyl]-(3-ethoxypropyl)ammonium CAS Name: 3-ethoxypropyl-[2-oxo-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]ammonium IUPAC Name: [2-[benzyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-(3-ethoxypropyl)azanium Traditional Name: [2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-(3-ethoxypropyl)ammonium Formula: C19H27N2O2S+ MolecularWeight: 347.49488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O2S/c1-2-23-12-7-11-20-14-19(22)21(16-18-10-6-13-24-18)15-17-8-4-3-5-9-17/h3-6,8-10,13,20H,2,7,11-12,14-16H2,1H3/p+1