2-chloranyl-9-methoxy-6-piperazin-1-yl-benzo[b][1,4]benzoxazepine

Systemtic Name: 2-chloranyl-9-methoxy-6-piperazin-1-yl-benzo[b][1,4]benzoxazepine Openeye Name: 2-chloro-9-methoxy-6-piperazin-1-yl-benzo[b][1,4]benzoxazepine CAS Name: 2-chloro-9-methoxy-6-(1-piperazinyl)benzo[b][1,4]benzoxazepine IUPAC Name: 2-chloro-9-methoxy-6-piperazin-1-ylbenzo[b][1,4]benzoxazepine Traditional Name: 2-chloro-9-methoxy-6-piperazino-benzo[b][1,4]benzoxazepine Formula: C18H18ClN3O2 MolecularWeight: 343.80742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC3=C(O2)C=C(C=C3)Cl)N4CCNCC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC3=C(O2)C=C(C=C3)Cl)N4CCNCC4

InChI

InChI=1S/C18H18ClN3O2/c1-23-13-3-4-14-16(11-13)24-17-10-12(19)2-5-15(17)21-18(14)22-8-6-20-7-9-22/h2-5,10-11,20H,6-9H2,1H3