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

Systemtic Name: azepan-2-ylidene-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-(4-methoxyphenyl)azanium Openeye Name: azepan-2-ylidene-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]-(4-methoxyphenyl)ammonium CAS Name: 2-azepanylidene-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-(4-methoxyphenyl)ammonium IUPAC Name: azepan-2-ylidene-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-(4-methoxyphenyl)azanium Traditional Name: azepan-2-ylidene-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]-(4-methoxyphenyl)ammonium Formula: C23H29N2O4+ MolecularWeight: 397.48736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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