[2-[furan-2-ylmethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: [2-[furan-2-ylmethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: [2-[benzyl(2-furylmethyl)amino]-2-oxo-ethyl]-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: [2-[2-furanylmethyl-(phenylmethyl)amino]-2-oxoethyl]-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: [2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: [2-[benzyl(2-furfuryl)amino]-2-keto-ethyl]-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C20H29N3O3+2 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC[NH2+]CC(=O)N(CC2=CC=CC=C2)CC3=CC=CO3

Isomeric SMILES

C1COCC[NH+]1CC[NH2+]CC(=O)N(CC2=CC=CC=C2)CC3=CC=CO3

InChI

InChI=1S/C20H27N3O3/c24-20(15-21-8-9-22-10-13-25-14-11-22)23(17-19-7-4-12-26-19)16-18-5-2-1-3-6-18/h1-7,12,21H,8-11,13-17H2/p+2