N-[4-[4-(2,3-diethylphenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide

Systemtic Name: N-[4-[4-(2,3-diethylphenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide Openeye Name: N-[4-[4-(2,3-diethylphenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide CAS Name: N-[4-[4-(2,3-diethylphenyl)-1-piperazinyl]butyl]-2-anthracenecarboxamide IUPAC Name: N-[4-[4-(2,3-diethylphenyl)piperazin-1-yl]butyl]anthracene-2-carboxamide Traditional Name: N-[4-[4-(2,3-diethylphenyl)piperazino]butyl]anthracene-2-carboxamide Formula: C33H39N3O MolecularWeight: 493.68226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)N2CCN(CC2)CCCCNC(=O)C3=CC4=CC5=CC=CC=C5C=C4C=C3)CC

Isomeric SMILES

CCC1=C(C(=CC=C1)N2CCN(CC2)CCCCNC(=O)C3=CC4=CC5=CC=CC=C5C=C4C=C3)CC

InChI

InChI=1S/C33H39N3O/c1-3-25-12-9-13-32(31(25)4-2)36-20-18-35(19-21-36)17-8-7-16-34-33(37)29-15-14-28-22-26-10-5-6-11-27(26)23-30(28)24-29/h5-6,9-15,22-24H,3-4,7-8,16-21H2,1-2H3,(H,34,37)