4-ethoxy-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-ethoxy-N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 4-ethoxy-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-ethoxy-N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-ethoxy-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-ethoxy-N-[4-(4-p-toluoylpiperazino)phenyl]benzamide Formula: C27H29N3O3 MolecularWeight: 443.53746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H29N3O3/c1-3-33-25-14-8-21(9-15-25)26(31)28-23-10-12-24(13-11-23)29-16-18-30(19-17-29)27(32)22-6-4-20(2)5-7-22/h4-15H,3,16-19H2,1-2H3,(H,28,31)