(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[(E)-3-phenylprop-2-enyl]azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[(E)-3-phenylprop-2-enyl]azanium Openeye Name: [(E)-cinnamyl]-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-ethyl-ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[(E)-3-phenylprop-2-enyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[(E)-3-phenylprop-2-enyl]azanium Traditional Name: [(E)-cinnamyl]-ethyl-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C22H26N3O3+ MolecularWeight: 380.46014

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC=CC1=CC=CC=C1)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CC[NH+](C/C=C/C1=CC=CC=C1)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C22H25N3O3/c1-4-25(12-8-11-16-9-6-5-7-10-16)15-21-23-18-14-20(28-3)19(27-2)13-17(18)22(26)24-21/h5-11,13-14H,4,12,15H2,1-3H3,(H,23,24,26)/p+1/b11-8+