3-bromanyl-10-methyl-6-piperazin-1-yl-benzo[b][1,4]benzoxazepine

Systemtic Name: 3-bromanyl-10-methyl-6-piperazin-1-yl-benzo[b][1,4]benzoxazepine Openeye Name: 3-bromo-10-methyl-6-piperazin-1-yl-benzo[b][1,4]benzoxazepine CAS Name: 3-bromo-10-methyl-6-(1-piperazinyl)benzo[b][1,4]benzoxazepine IUPAC Name: 3-bromo-10-methyl-6-piperazin-1-ylbenzo[b][1,4]benzoxazepine Traditional Name: 3-bromo-10-methyl-6-piperazino-benzo[b][1,4]benzoxazepine Formula: C18H18BrN3O MolecularWeight: 372.25902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC3=C(C=C(C=C3)Br)N=C2N4CCNCC4

Isomeric SMILES

CC1=CC=CC2=C1OC3=C(C=C(C=C3)Br)N=C2N4CCNCC4

InChI

InChI=1S/C18H18BrN3O/c1-12-3-2-4-14-17(12)23-16-6-5-13(19)11-15(16)21-18(14)22-9-7-20-8-10-22/h2-6,11,20H,7-10H2,1H3