azepan-2-ylidene-(2,3-dihydro-1,4-benzodioxin-6-yl)-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: azepan-2-ylidene-(2,3-dihydro-1,4-benzodioxin-6-yl)-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]azanium Openeye Name: azepan-2-ylidene-(2,3-dihydro-1,4-benzodioxin-6-yl)-[2-(4-ethoxyphenyl)-2-oxo-ethyl]ammonium CAS Name: 2-azepanylidene-(2,3-dihydro-1,4-benzodioxin-6-yl)-[2-(4-ethoxyphenyl)-2-oxoethyl]ammonium IUPAC Name: azepan-2-ylidene-(2,3-dihydro-1,4-benzodioxin-6-yl)-[2-(4-ethoxyphenyl)-2-oxoethyl]azanium Traditional Name: azepan-2-ylidene-(2,3-dihydro-1,4-benzodioxin-6-yl)-(2-keto-2-p-phenetyl-ethyl)ammonium Formula: C24H29N2O4+ MolecularWeight: 409.49806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCCN2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C[N+](=C2CCCCCN2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C24H28N2O4/c1-2-28-20-10-7-18(8-11-20)21(27)17-26(24-6-4-3-5-13-25-24)19-9-12-22-23(16-19)30-15-14-29-22/h7-12,16H,2-6,13-15,17H2,1H3/p+1