(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: (2-keto-7,8-dimethyl-chromen-4-yl)methyl-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C22H22N3O3+ MolecularWeight: 376.42838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC3=NC(=O)C4=CC=CC=C4N3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC3=NC(=O)C4=CC=CC=C4N3)C

InChI

InChI=1S/C22H21N3O3/c1-13-8-9-16-15(10-20(26)28-21(16)14(13)2)11-25(3)12-19-23-18-7-5-4-6-17(18)22(27)24-19/h4-10H,11-12H2,1-3H3,(H,23,24,27)/p+1