3-ethoxy-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-4-propoxy-benzamide

Systemtic Name: 3-ethoxy-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-4-propoxy-benzamide Openeye Name: 3-ethoxy-N-[4-[4-(m-tolyl)piperazin-1-yl]butyl]-4-propoxy-benzamide CAS Name: 3-ethoxy-N-[4-[4-(3-methylphenyl)-1-piperazinyl]butyl]-4-propoxybenzamide IUPAC Name: 3-ethoxy-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butyl]-4-propoxybenzamide Traditional Name: 3-ethoxy-N-[4-[4-(m-tolyl)piperazino]butyl]-4-propoxy-benzamide Formula: C27H39N3O3 MolecularWeight: 453.61686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NCCCCN2CCN(CC2)C3=CC=CC(=C3)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NCCCCN2CCN(CC2)C3=CC=CC(=C3)C)OCC

InChI

InChI=1S/C27H39N3O3/c1-4-19-33-25-12-11-23(21-26(25)32-5-2)27(31)28-13-6-7-14-29-15-17-30(18-16-29)24-10-8-9-22(3)20-24/h8-12,20-21H,4-7,13-19H2,1-3H3,(H,28,31)