N-[4-(4-hexanoylpiperazin-1-yl)phenyl]naphthalene-1-carboxamide

Systemtic Name: N-[4-(4-hexanoylpiperazin-1-yl)phenyl]naphthalene-1-carboxamide Openeye Name: N-[4-(4-hexanoylpiperazin-1-yl)phenyl]naphthalene-1-carboxamide CAS Name: N-[4-[4-(1-oxohexyl)-1-piperazinyl]phenyl]-1-naphthalenecarboxamide IUPAC Name: N-[4-(4-hexanoylpiperazin-1-yl)phenyl]naphthalene-1-carboxamide Traditional Name: N-[4-(4-caproylpiperazino)phenyl]-1-naphthamide Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H31N3O2/c1-2-3-4-12-26(31)30-19-17-29(18-20-30)23-15-13-22(14-16-23)28-27(32)25-11-7-9-21-8-5-6-10-24(21)25/h5-11,13-16H,2-4,12,17-20H2,1H3,(H,28,32)