[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: [4-[2-(tert-butylamino)-2-oxo-ethoxy]-3-methoxy-phenyl]methyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: [4-[2-(tert-butylamino)-2-oxoethoxy]-3-methoxyphenyl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: [4-[2-(tert-butylamino)-2-keto-ethoxy]-3-methoxy-benzyl]-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C20H35N3O4+2 MolecularWeight: 381.5096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)C[NH2+]CC[NH+]2CCOCC2)OC

Isomeric SMILES

CC(C)(C)NC(=O)COC1=C(C=C(C=C1)C[NH2+]CC[NH+]2CCOCC2)OC

InChI

InChI=1S/C20H33N3O4/c1-20(2,3)22-19(24)15-27-17-6-5-16(13-18(17)25-4)14-21-7-8-23-9-11-26-12-10-23/h5-6,13,21H,7-12,14-15H2,1-4H3,(H,22,24)/p+2