3-ethoxypropyl-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 3-ethoxypropyl-[2-[(3-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-(3-ethoxypropyl)ammonium CAS Name: 3-ethoxypropyl-[2-[(3-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]ammonium IUPAC Name: [2-[benzyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-(3-ethoxypropyl)azanium Traditional Name: [2-[benzyl-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-(3-ethoxypropyl)ammonium Formula: C20H29N2O2S+ MolecularWeight: 361.52146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O2S/c1-3-24-12-7-11-21-14-20(23)22(15-18-8-5-4-6-9-18)16-19-17(2)10-13-25-19/h4-6,8-10,13,21H,3,7,11-12,14-16H2,1-2H3/p+1