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5-bromanyl-2-[4-(hexadecylamino)phenyl]pentanamide

Systemtic Name:	5-bromanyl-2-[4-(hexadecylamino)phenyl]pentanamide
Openeye Name:	5-bromo-2-[4-(hexadecylamino)phenyl]pentanamide
CAS Name:	5-bromo-2-[4-(hexadecylamino)phenyl]pentanamide
IUPAC Name:	5-bromo-2-[4-(hexadecylamino)phenyl]pentanamide
Traditional Name:	5-bromo-2-[4-(cetylamino)phenyl]valeramide
Formula:	C₂₇H₄₇BrN₂O
MolecularWeight:	495.57888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(CCCBr)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(CCCBr)C(=O)N

InChI

InChI=1S/C27H47BrN2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-30-25-20-18-24(19-21-25)26(27(29)31)17-16-22-28/h18-21,26,30H,2-17,22-23H2,1H3,(H2,29,31)

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