8-chloranyl-11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepine-11-carbonitrile

Systemtic Name: 8-chloranyl-11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepine-11-carbonitrile Openeye Name: 8-chloro-11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepine-11-carbonitrile CAS Name: 8-chloro-11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepin-11-carbonitrile IUPAC Name: 8-chloro-11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepine-11-carbonitrile Traditional Name: 8-chloro-11-[3-(dimethylamino)propyl]-6H-benzo[c][1]benzoxepin-11-carbonitrile Formula: C20H21ClN2O MolecularWeight: 340.84654

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC1(C2=C(COC3=CC=CC=C31)C=C(C=C2)Cl)C#N

Isomeric SMILES

CN(C)CCCC1(C2=C(COC3=CC=CC=C31)C=C(C=C2)Cl)C#N

InChI

InChI=1S/C20H21ClN2O/c1-23(2)11-5-10-20(14-22)17-9-8-16(21)12-15(17)13-24-19-7-4-3-6-18(19)20/h3-4,6-9,12H,5,10-11,13H2,1-2H3