azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(2,5-dimethoxyphenyl)-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]ammonium Formula: C24H31N2O5+ MolecularWeight: 427.51334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)[N+](=C2CCCCCN2)CC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[N+](=C2CCCCCN2)CC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H30N2O5/c1-28-18-10-12-21(29-2)19(15-18)26(24-8-6-5-7-13-25-24)16-20(27)17-9-11-22(30-3)23(14-17)31-4/h9-12,14-15H,5-8,13,16H2,1-4H3/p+1