3-chloranyl-6-(4-nonylpiperazin-1-yl)benzo[b][1,4]benzoxazepine

Systemtic Name: 3-chloranyl-6-(4-nonylpiperazin-1-yl)benzo[b][1,4]benzoxazepine Openeye Name: 3-chloro-6-(4-nonylpiperazin-1-yl)benzo[b][1,4]benzoxazepine CAS Name: 3-chloro-6-(4-nonyl-1-piperazinyl)benzo[b][1,4]benzoxazepine IUPAC Name: 3-chloro-6-(4-nonylpiperazin-1-yl)benzo[b][1,4]benzoxazepine Traditional Name: 3-chloro-6-(4-nonylpiperazino)benzo[b][1,4]benzoxazepine Formula: C26H34ClN3O MolecularWeight: 440.02066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C42

Isomeric SMILES

CCCCCCCCCN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)OC4=CC=CC=C42

InChI

InChI=1S/C26H34ClN3O/c1-2-3-4-5-6-7-10-15-29-16-18-30(19-17-29)26-22-11-8-9-12-24(22)31-25-14-13-21(27)20-23(25)28-26/h8-9,11-14,20H,2-7,10,15-19H2,1H3