1-(3-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-[(E)-3-phenylprop-2-enyl]piperazine

Systemtic Name: 1-(3-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-[(E)-3-phenylprop-2-enyl]piperazine Openeye Name: 1-[(E)-cinnamyl]-4-(3-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)piperazine CAS Name: 1-(3-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-[(E)-3-phenylprop-2-enyl]piperazine IUPAC Name: 1-(3-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-4-[(E)-3-phenylprop-2-enyl]piperazine Traditional Name: 1-[(E)-cinnamyl]-4-(3-methyl-6,11-dihydrobenzo[c][1]benzoxepin-11-yl)piperazine Formula: C28H30N2O MolecularWeight: 410.5506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(C3=CC=CC=C3CO2)N4CCN(CC4)CC=CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)C(C3=CC=CC=C3CO2)N4CCN(CC4)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C28H30N2O/c1-22-13-14-26-27(20-22)31-21-24-11-5-6-12-25(24)28(26)30-18-16-29(17-19-30)15-7-10-23-8-3-2-4-9-23/h2-14,20,28H,15-19,21H2,1H3/b10-7+