1-[4-[1-[4-(azepan-1-yl)-2-methoxy-phenyl]ethenyl]-3-methoxy-phenyl]azepane

Systemtic Name: 1-[4-[1-[4-(azepan-1-yl)-2-methoxy-phenyl]ethenyl]-3-methoxy-phenyl]azepane Openeye Name: 1-[4-[1-[4-(azepan-1-yl)-2-methoxy-phenyl]vinyl]-3-methoxy-phenyl]azepane CAS Name: 1-[4-[1-[4-(1-azepanyl)-2-methoxyphenyl]ethenyl]-3-methoxyphenyl]azepane IUPAC Name: 1-[4-[1-[4-(azepan-1-yl)-2-methoxyphenyl]ethenyl]-3-methoxyphenyl]azepane Traditional Name: 1-[4-[1-[4-(azepan-1-yl)-2-methoxy-phenyl]vinyl]-3-methoxy-phenyl]azepane Formula: C28H38N2O2 MolecularWeight: 434.61352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CCCCCC2)C(=C)C3=C(C=C(C=C3)N4CCCCCC4)OC

Isomeric SMILES

COC1=C(C=CC(=C1)N2CCCCCC2)C(=C)C3=C(C=C(C=C3)N4CCCCCC4)OC

InChI

InChI=1S/C28H38N2O2/c1-22(25-14-12-23(20-27(25)31-2)29-16-8-4-5-9-17-29)26-15-13-24(21-28(26)32-3)30-18-10-6-7-11-19-30/h12-15,20-21H,1,4-11,16-19H2,2-3H3