1,4-bis[(6-ethoxynaphthalen-2-yl)sulfonyl]-1,4-diazepane

Systemtic Name: 1,4-bis[(6-ethoxynaphthalen-2-yl)sulfonyl]-1,4-diazepane Openeye Name: 1,4-bis[(6-ethoxy-2-naphthyl)sulfonyl]-1,4-diazepane CAS Name: 1,4-bis[(6-ethoxy-2-naphthalenyl)sulfonyl]-1,4-diazepane IUPAC Name: 1,4-bis[(6-ethoxynaphthalen-2-yl)sulfonyl]-1,4-diazepane Traditional Name: 1,4-bis[(6-ethoxy-2-naphthyl)sulfonyl]-1,4-diazepane Formula: C29H32N2O6S2 MolecularWeight: 568.70418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)N3CCCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)N3CCCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)OCC

InChI

InChI=1S/C29H32N2O6S2/c1-3-36-26-10-6-24-20-28(12-8-22(24)18-26)38(32,33)30-14-5-15-31(17-16-30)39(34,35)29-13-9-23-19-27(37-4-2)11-7-25(23)21-29/h6-13,18-21H,3-5,14-17H2,1-2H3