N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]naphthalene-1-carboxamide

Systemtic Name: N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]naphthalene-1-carboxamide Openeye Name: N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]naphthalene-1-carboxamide CAS Name: N-[4-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]phenyl]-1-naphthalenecarboxamide IUPAC Name: N-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]naphthalene-1-carboxamide Traditional Name: N-[4-[4-(2-ethylbutanoyl)piperazino]phenyl]-1-naphthamide Formula: C27H31N3O2 MolecularWeight: 429.55394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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