1-[4-[1-[4-(azepan-1-yl)-2-methoxy-phenyl]buta-1,3-dienyl]-3-methoxy-phenyl]azepane

Systemtic Name: 1-[4-[1-[4-(azepan-1-yl)-2-methoxy-phenyl]buta-1,3-dienyl]-3-methoxy-phenyl]azepane Openeye Name: 1-[4-[1-[4-(azepan-1-yl)-2-methoxy-phenyl]buta-1,3-dienyl]-3-methoxy-phenyl]azepane CAS Name: 1-[4-[1-[4-(1-azepanyl)-2-methoxyphenyl]buta-1,3-dienyl]-3-methoxyphenyl]azepane IUPAC Name: 1-[4-[1-[4-(azepan-1-yl)-2-methoxyphenyl]buta-1,3-dienyl]-3-methoxyphenyl]azepane Traditional Name: 1-[4-[1-[4-(azepan-1-yl)-2-methoxy-phenyl]buta-1,3-dienyl]-3-methoxy-phenyl]azepane Formula: C30H40N2O2 MolecularWeight: 460.6508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H40N2O2/c1-4-13-26(27-16-14-24(22-29(27)33-2)31-18-9-5-6-10-19-31)28-17-15-25(23-30(28)34-3)32-20-11-7-8-12-21-32/h4,13-17,22-23H,1,5-12,18-21H2,2-3H3