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

Systemtic Name: azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(2,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(2,5-dimethoxyphenyl)-[2-keto-2-(4-methoxyphenyl)ethyl]ammonium Formula: C23H29N2O4+ MolecularWeight: 397.48736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O4/c1-27-18-10-8-17(9-11-18)21(26)16-25(23-7-5-4-6-14-24-23)20-15-19(28-2)12-13-22(20)29-3/h8-13,15H,4-7,14,16H2,1-3H3/p+1