4-[5-bromanyl-2-(propylaminomethyl)phenyl]piperazin-2-one

Systemtic Name: 4-[5-bromanyl-2-(propylaminomethyl)phenyl]piperazin-2-one Openeye Name: 4-[5-bromo-2-(propylaminomethyl)phenyl]piperazin-2-one CAS Name: 4-[5-bromo-2-(propylaminomethyl)phenyl]-2-piperazinone IUPAC Name: 4-[5-bromo-2-(propylaminomethyl)phenyl]piperazin-2-one Traditional Name: 4-[5-bromo-2-(propylaminomethyl)phenyl]piperazin-2-one Formula: C14H20BrN3O MolecularWeight: 326.2321

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C(C=C(C=C1)Br)N2CCNC(=O)C2

Isomeric SMILES

CCCNCC1=C(C=C(C=C1)Br)N2CCNC(=O)C2

InChI

InChI=1S/C14H20BrN3O/c1-2-5-16-9-11-3-4-12(15)8-13(11)18-7-6-17-14(19)10-18/h3-4,8,16H,2,5-7,9-10H2,1H3,(H,17,19)