11-(4-butylpiperazin-1-yl)-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine

Systemtic Name: 11-(4-butylpiperazin-1-yl)-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine Openeye Name: 11-(4-butylpiperazin-1-yl)-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine CAS Name: 11-(4-butyl-1-piperazinyl)-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine IUPAC Name: 11-(4-butylpiperazin-1-yl)-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine Traditional Name: 11-(4-butylpiperazino)-5,11-dihydro-[1]benzoxepino[3,4-b]pyridine Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2C3=C(COC4=CC=CC=C24)N=CC=C3

Isomeric SMILES

CCCCN1CCN(CC1)C2C3=C(COC4=CC=CC=C24)N=CC=C3

InChI

InChI=1S/C21H27N3O/c1-2-3-11-23-12-14-24(15-13-23)21-17-8-6-10-22-19(17)16-25-20-9-5-4-7-18(20)21/h4-10,21H,2-3,11-16H2,1H3