[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-methyl-[(3-oxobenzo[f]chromen-1-yl)methyl]ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-methyl-[(3-oxo-1-benzo[f][1]benzopyranyl)methyl]ammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-methyl-[(3-oxobenzo[f]chromen-1-yl)methyl]azanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[(3-ketobenzo[f]chromen-1-yl)methyl]-methyl-ammonium Formula: C21H25N2O3+ MolecularWeight: 353.4348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+](C)CC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+](C)CC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2

InChI

InChI=1S/C21H24N2O3/c1-21(2,3)22-18(24)13-23(4)12-15-11-19(25)26-17-10-9-14-7-5-6-8-16(14)20(15)17/h5-11H,12-13H2,1-4H3,(H,22,24)/p+1