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

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]-methyl-azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]-methyl-ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl]-methylammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(6,7-dimethyl-2-oxochromen-4-yl)methyl]-methylazanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]-methyl-ammonium Formula: C22H24NO4+ MolecularWeight: 366.43026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3COC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)C[C@H]3COC4=CC=CC=C4O3)C

InChI

InChI=1S/C22H23NO4/c1-14-8-18-16(10-22(24)27-21(18)9-15(14)2)11-23(3)12-17-13-25-19-6-4-5-7-20(19)26-17/h4-10,17H,11-13H2,1-3H3/p+1/t17-/m0/s1