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

Systemtic Name: azepan-2-ylidene-(2,4-dimethoxyphenyl)-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(2,4-dimethoxyphenyl)-[2-(4-ethoxyphenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(2,4-dimethoxyphenyl)-[2-(4-ethoxyphenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(2,4-dimethoxyphenyl)-[2-(4-ethoxyphenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(2,4-dimethoxyphenyl)-(2-keto-2-p-phenetyl-ethyl)ammonium Formula: C24H31N2O4+ MolecularWeight: 411.51394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCCN2)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCCN2)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C24H30N2O4/c1-4-30-19-11-9-18(10-12-19)22(27)17-26(24-8-6-5-7-15-25-24)21-14-13-20(28-2)16-23(21)29-3/h9-14,16H,4-8,15,17H2,1-3H3/p+1