9-methoxy-6-(3-methylpiperazin-1-yl)-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine

Systemtic Name: 9-methoxy-6-(3-methylpiperazin-1-yl)-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine Openeye Name: 9-methoxy-6-(3-methylpiperazin-1-yl)-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine CAS Name: 9-methoxy-6-(3-methyl-1-piperazinyl)-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine IUPAC Name: 9-methoxy-6-(3-methylpiperazin-1-yl)-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine Traditional Name: 9-methoxy-6-(3-methylpiperazino)-3-(trifluoromethyl)benzo[b][1,4]benzoxazepine Formula: C20H20F3N3O2 MolecularWeight: 391.38691

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=NC3=C(C=CC(=C3)C(F)(F)F)OC4=C2C=CC(=C4)OC

Isomeric SMILES

CC1CN(CCN1)C2=NC3=C(C=CC(=C3)C(F)(F)F)OC4=C2C=CC(=C4)OC

InChI

InChI=1S/C20H20F3N3O2/c1-12-11-26(8-7-24-12)19-15-5-4-14(27-2)10-18(15)28-17-6-3-13(20(21,22)23)9-16(17)25-19/h3-6,9-10,12,24H,7-8,11H2,1-2H3