2-(3,4-dimethoxyphenyl)ethyl-(1,3,4,5-tetrahydro-1-benzazepin-2-ylidene)azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-(1,3,4,5-tetrahydro-1-benzazepin-2-ylidene)azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-(1,3,4,5-tetrahydro-1-benzazepin-2-ylidene)ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-(1,3,4,5-tetrahydro-1-benzazepin-2-ylidene)ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-(1,3,4,5-tetrahydro-1-benzazepin-2-ylidene)azanium Traditional Name: homoveratryl(1,3,4,5-tetrahydro-1-benzazepin-2-ylidene)ammonium Formula: C20H25N2O2+ MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH+]=C2CCCC3=CC=CC=C3N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH+]=C2CCCC3=CC=CC=C3N2)OC

InChI

InChI=1S/C20H24N2O2/c1-23-18-11-10-15(14-19(18)24-2)12-13-21-20-9-5-7-16-6-3-4-8-17(16)22-20/h3-4,6,8,10-11,14H,5,7,9,12-13H2,1-2H3,(H,21,22)/p+1