(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]azanium

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]azanium Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]ammonium CAS Name: (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]ammonium IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]azanium Traditional Name: (7-acetamido-2-keto-chromen-4-yl)methyl-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]ammonium Formula: C24H27N2O5+ MolecularWeight: 423.48158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)[NH2+]CC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

Isomeric SMILES

CC(C)[C@@H](C1=CC2=C(C=C1)OCCO2)[NH2+]CC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

InChI

InChI=1S/C24H26N2O5/c1-14(2)24(16-4-7-20-22(10-16)30-9-8-29-20)25-13-17-11-23(28)31-21-12-18(26-15(3)27)5-6-19(17)21/h4-7,10-12,14,24-25H,8-9,13H2,1-3H3,(H,26,27)/p+1/t24-/m0/s1